data_2kl8_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2kl8 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.418 ' HE3' ' HA ' ' A' ' 51' ' ' GLU . 59.0 ttp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.809 0.338 . . . . 75.25 110.761 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.446 ' HG3' ' HA ' ' A' ' 47' ' ' THR . 4.5 mp0 -104.75 165.9 10.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.349 -0.387 . . . . 74.329999999999998 110.721 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.441 ' HE1' HG12 ' A' ' 5' ' ' ILE . 27.4 ttt -143.83 117.34 9.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.108 -0.37 . . . . 75.140000000000001 111.804 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 20.9 m-20 -94.62 103.85 15.79 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.812 0.339 . . . . 71.439999999999998 111.188 176.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.441 HG12 ' HE1' ' A' ' 3' ' ' MET . 47.5 mt -99.43 108.89 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.893 0.377 . . . . 71.230000000000004 110.563 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 58.0 mtp180 -99.94 107.21 19.12 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.604 -0.271 . . . . 74.129999999999995 111.497 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -90.35 126.58 35.92 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.796 0.331 . . . . 65.349999999999994 111.161 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.548 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 73.8 ttt-85 -127.06 120.12 28.22 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 110.067 -0.346 . . . . 74.549999999999997 110.067 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -142.57 -170.73 12.89 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 120.653 -0.784 . . . . 74.540000000000006 113.853 -172.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -103.9 -47.06 4.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.561 0.578 . . . . 72.409999999999997 112.561 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -100.83 152.79 20.1 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.961 -0.462 . . . . 73.430000000000007 111.688 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.97 -36.66 85.11 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.175 0.435 . . . . 72.439999999999998 112.175 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -58.53 -32.82 69.21 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.384 -0.371 . . . . 74.120000000000005 111.248 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.37 -45.48 80.5 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.063 0.459 . . . . 75.120000000000005 111.143 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -67.5 -47.05 71.12 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.142 0.496 . . . . 75.129999999999995 110.792 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -54.41 -57.94 9.37 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.723 -0.671 . . . . 71.420000000000002 112.14 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -65.33 -47.82 75.18 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.272 -0.422 . . . . 75.310000000000002 111.6 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.7 -51.2 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.403 . . . . 73.549999999999997 111.582 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.23 -45.06 88.39 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.139 0.495 . . . . 74.209999999999994 111.447 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -67.31 -31.73 72.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.141 -0.481 . . . . 74.299999999999997 111.752 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.402 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 27.0 mm-40 -70.18 -39.16 75.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.762 0.315 . . . . 73.310000000000002 111.444 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 90.5 mmm -59.93 -52.45 65.38 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.543 -0.299 . . . . 75.540000000000006 110.532 174.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.482 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 72.5 mt -58.02 -40.45 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.139 0.495 . . . . 70.140000000000001 111.209 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.402 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 68.9 ttt180 -48.52 -58.73 4.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.689 -0.687 . . . . 73.540000000000006 111.824 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -75.73 -39.22 57.63 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.41 0.522 . . . . 73.540000000000006 112.41 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.2 -30.03 59.11 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.563 0.579 . . . . 74.409999999999997 112.563 -175.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 74.9 mtp180 -59.87 -28.99 68.01 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.081 0.4 . . . . 75.140000000000001 112.081 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 12.7 mptt -74.16 -14.9 61.02 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.678 0.275 . . . . 74.540000000000006 111.56 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -110.79 149.47 30.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.84 0.352 . . . . 72.120000000000005 111.016 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.08 58.17 1.94 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.281 0.562 . . . . 61.299999999999997 111.559 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -131.0 133.15 7.13 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 116.107 -0.497 . . . . 75.549999999999997 112.276 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.4 m -85.97 117.83 25.06 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.857 0.361 . . . . 75.239999999999995 111.627 -176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -92.31 109.59 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.229 0.538 . . . . 75.150000000000006 111.927 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.4 p -113.41 153.58 28.37 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.153 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -156.43 149.05 23.69 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.667 0.617 . . . . 73.400000000000006 112.667 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.1 p -130.29 126.57 37.57 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.637 -0.71 . . . . 70.209999999999994 110.811 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.1 tp -97.87 99.42 10.74 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.048 0.452 . . . . 75.040000000000006 110.926 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -106.18 106.66 17.28 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.967 0.413 . . . . 72.040000000000006 110.838 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 60.7 -112.92 5.03 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.12 -0.562 . . . . 63.329999999999998 112.335 -175.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 47.3 t-20 -115.67 72.3 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.03 0.443 . . . . 72.219999999999999 110.175 173.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -175.99 122.28 0.18 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.576 -0.738 . . . . 63.450000000000003 109.785 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.2 tp -104.74 101.14 10.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 72.010000000000005 111.047 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -85.09 104.45 15.01 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.472 -0.331 . . . . 75.200000000000003 111.095 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.9 mt -99.6 109.07 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 111.773 0.286 . . . . 74.409999999999997 111.773 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -98.87 106.23 18.47 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.185 0.517 . . . . 72.540000000000006 111.578 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.9 mt -91.8 112.01 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 116.184 -0.462 . . . . 73.340000000000003 110.298 174.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.446 ' HA ' ' HG3' ' A' ' 2' ' ' GLU . 91.7 m -93.04 120.44 33.34 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 112.0 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.87 65.13 1.09 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.434 -0.412 . . . . 72.409999999999997 113.922 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.4 m -122.06 136.56 26.4 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 122.405 -0.468 . . . . 74.540000000000006 111.914 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -78.65 150.8 24.72 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.598 2.199 . . . . 73.140000000000001 112.461 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 12.1 pt-20 -60.06 -30.63 69.34 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.852 0.686 . . . . 64.230000000000004 112.852 -174.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.421 ' HG3' HG23 ' A' ' 53' ' ' VAL . 28.9 pt20 -63.58 -45.62 89.59 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.948 0.404 . . . . 74.420000000000002 111.308 177.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.421 HG23 ' HG3' ' A' ' 52' ' ' GLN . 61.3 t -77.08 -27.72 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.869 0.366 . . . . 65.239999999999995 111.109 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.2 ttp180 -48.94 -40.98 32.38 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.161 0.505 . . . . 71.430000000000007 111.193 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -60.91 -51.84 67.58 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.822 -0.626 . . . . 71.420000000000002 111.311 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -62.09 -44.65 96.19 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.828 -0.624 . . . . 75.329999999999998 112.097 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.31 -45.68 75.79 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.771 0.319 . . . . 71.409999999999997 111.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.91 94.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.059 0.457 . . . . 73.439999999999998 111.508 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -72.27 -34.89 68.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.156 -0.475 . . . . 65.230000000000004 112.064 -178.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -71.39 -31.99 67.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.262 -0.575 . . . . 74.299999999999997 110.566 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.09 -44.09 78.67 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.951 0.405 . . . . 72.299999999999997 110.498 171.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -58.1 -50.0 74.99 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.335 0.588 . . . . 70.239999999999995 110.43 172.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -53.41 -48.77 68.4 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.347 -0.842 . . . . 72.329999999999998 111.475 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.73 -50.69 72.39 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.182 0.515 . . . . 71.510000000000005 111.046 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.39 65.69 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.09 -0.504 . . . . 72.430000000000007 111.868 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -74.38 -59.8 2.56 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 122.372 -0.205 . . . . 75.319999999999993 111.463 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -35.45 70.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.304 0.483 . . . . 72.310000000000002 112.304 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -92.79 -6.87 48.0 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.185 -0.322 . . . . 74.25 111.8 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.1 t30 57.93 15.83 3.34 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.395 0.617 . . . . 73.140000000000001 111.828 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.1 pt -87.1 174.88 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.051 0.453 . . . . 71.409999999999997 111.84 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.1 m -90.01 139.06 30.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.196 -0.456 . . . . 75.409999999999997 111.317 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.2 p -135.67 126.6 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.183 0.516 . . . . 74.040000000000006 111.472 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 71.8 p -129.64 120.53 25.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.419 -0.355 . . . . 70.549999999999997 110.333 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -121.22 117.79 27.97 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.063 0.459 . . . . 75.439999999999998 112.019 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.8 m -98.82 116.86 31.99 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.902 0.382 . . . . 74.530000000000001 111.037 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.6 mm -82.0 112.37 19.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 116.446 -0.343 . . . . 74.5 111.041 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 77' ' ' ARG . 19.3 mmm180 . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 120.936 0.398 . . . . 72.519999999999996 110.552 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.448 ' HE2' ' HA ' ' A' ' 51' ' ' GLU . 75.3 mtm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.779 0.323 . . . . 74.030000000000001 111.468 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.566 ' HB2' ' HG3' ' A' ' 77' ' ' ARG . 39.8 mt-10 -124.32 163.09 22.42 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.281 0.563 . . . . 72.510000000000005 111.862 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.67 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 25.7 ttt -143.59 111.95 6.34 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.061 -0.518 . . . . 74.140000000000001 111.613 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.43 120.78 28.13 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.661 0.267 . . . . 71.319999999999993 111.043 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' A' ' 44' ' ' ILE . 22.5 mt -124.64 147.64 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.876 0.37 . . . . 73.129999999999995 111.814 -174.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.05 110.37 8.44 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.429 -0.35 . . . . 74.510000000000005 110.987 170.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -89.28 124.18 34.17 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.825 -0.435 . . . . 71.239999999999995 109.825 172.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 58.2 ttt180 -124.24 125.44 44.4 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.024 0.44 . . . . 75.519999999999996 111.852 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 170.76 -168.12 41.24 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.846 -0.692 . . . . 61.299999999999997 113.608 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -123.07 90.17 3.24 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 122.666 0.386 . . . . 74.430000000000007 110.852 -179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -175.95 142.26 0.51 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.149 -0.478 . . . . 63.240000000000002 110.372 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 35.0 tp -89.28 -39.63 13.35 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 111.853 0.316 . . . . 74.409999999999997 111.853 -176.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -66.66 -32.26 73.46 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 122.17 -0.331 . . . . 73.319999999999993 111.251 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.69 -41.91 70.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.057 0.456 . . . . 74.129999999999995 110.909 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.455 ' CD1' HD23 ' A' ' 42' ' ' LEU . 62.4 t80 -58.83 -56.74 18.27 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.797 -0.638 . . . . 73.230000000000004 111.502 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.08 -52.33 63.11 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.144 0.424 . . . . 71.409999999999997 112.144 -176.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -62.43 -54.59 38.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.763 0.653 . . . . 74.530000000000001 112.763 -176.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.447 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -58.15 -43.86 87.59 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.92 0.391 . . . . 75.230000000000004 111.558 -178.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.2 tp -66.81 -42.54 85.75 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.975 0.417 . . . . 74.230000000000004 111.327 177.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -59.33 -52.77 64.23 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.155 -0.475 . . . . 75.329999999999998 111.985 -177.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -60.93 -49.59 76.85 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.203 0.445 . . . . 74.209999999999994 112.203 -176.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 51.4 mtp -62.94 -40.81 98.78 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.739 0.274 . . . . 63.350000000000001 111.739 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.3 mt -64.16 -41.92 93.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 120.974 0.416 . . . . 74.230000000000004 110.624 174.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.3 -46.53 79.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.061 -0.518 . . . . 74.109999999999999 111.136 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.56 ' O ' ' HG2' ' A' ' 28' ' ' LYS . 29.7 mt-30 -74.3 -36.11 63.72 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.308 0.484 . . . . 72.030000000000001 112.308 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.86 -47.1 87.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.934 -0.479 . . . . 73.310000000000002 111.618 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -59.63 -39.49 84.49 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.744 0.646 . . . . 72.450000000000003 112.744 -177.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 20.8 ptmt -69.37 -14.33 62.85 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.987 0.422 . . . . 75.129999999999995 111.372 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -108.43 15.18 24.15 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.445 -0.343 . . . . 75.040000000000006 111.119 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.88 16.81 10.63 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.532 0.567 . . . . 74.540000000000006 112.532 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -78.43 133.31 12.61 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 121.442 -0.409 . . . . 52.130000000000003 113.587 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.7 m -90.85 122.5 33.61 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.542 -0.387 . . . . 75.540000000000006 111.117 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.433 HG21 HG12 ' A' ' 46' ' ' ILE . 49.9 t -109.03 130.17 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 120.96 0.41 . . . . 72.540000000000006 111.871 -179.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.9 t -124.64 132.79 53.4 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.519 -0.309 . . . . 74.420000000000002 110.794 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.514 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.7 p90 -128.34 144.92 51.19 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.369 0.507 . . . . 73.209999999999994 112.369 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 37.8 p -137.84 133.24 33.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.96 -0.564 . . . . 74.040000000000006 111.13 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.55 115.44 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.747 0.308 . . . . 74.430000000000007 111.31 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -114.21 81.39 1.53 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.383 0.611 . . . . 65.230000000000004 111.496 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.72 -85.09 0.03 OUTLIER Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.814 0.685 . . . . 55.310000000000002 114.814 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -100.06 -10.74 21.21 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.473 0.546 . . . . 51.310000000000002 112.473 -171.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -146.51 160.87 41.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.065 0.765 . . . . 71.420000000000002 113.065 -175.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 35' ' ' TYR . 50.6 tp -101.49 116.31 32.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.501 -0.772 . . . . 74.109999999999999 111.883 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.418 ' HB2' ' OG1' ' A' ' 36' ' ' THR . 38.0 mt-10 -79.83 129.96 34.92 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.536 -0.302 . . . . 72.200000000000003 110.725 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' A' ' 5' ' ' ILE . 66.5 mt -134.58 121.86 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 122.407 0.283 . . . . 74.409999999999997 111.069 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' A' ' 3' ' ' MET . 42.5 ttm180 -118.66 120.84 38.63 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.073 0.463 . . . . 63.530000000000001 111.032 174.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 2' ' ' GLU . 49.7 mt -101.49 129.08 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 116.121 -0.49 . . . . 74.519999999999996 110.777 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.431 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 57.5 m -120.89 143.39 48.95 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.313 0.245 . . . . 75.340000000000003 111.6 -176.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.44 10.91 60.14 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.119 -0.562 . . . . 72.25 114.396 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.458 HG21 ' HE ' ' A' ' 54' ' ' ARG . 19.2 m -89.39 136.4 29.98 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 117.32 0.56 . . . . 74.430000000000007 112.077 179.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -73.09 174.32 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.976 2.451 . . . . 73.150000000000006 113.316 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.448 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 13.7 pt-20 -66.42 -49.38 66.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.624 0.972 . . . . 75.540000000000006 113.624 -171.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.21 -41.48 85.7 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.883 -0.51 . . . . 75.209999999999994 111.262 -176.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.59 -31.45 48.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.182 0.515 . . . . 70.310000000000002 110.992 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.67 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 3.8 tpm_? -52.51 -43.26 64.97 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 72.430000000000007 111.321 176.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.85 -52.85 62.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.811 -0.631 . . . . 73.150000000000006 111.68 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.74 -43.06 99.58 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.254 -0.43 . . . . 65.349999999999994 111.86 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.81 -36.77 84.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.961 0.41 . . . . 73.400000000000006 111.491 176.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.451 ' HA ' ' HE2' ' A' ' 3' ' ' MET . . . -65.9 -30.26 70.82 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.993 0.425 . . . . 70.439999999999998 111.328 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -78.3 -34.59 48.7 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 116.284 -0.416 . . . . 71.409999999999997 111.452 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.73 -41.49 97.71 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.776 0.287 . . . . 65.25 111.776 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -51.06 -43.59 60.99 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.103 0.478 . . . . 72.409999999999997 111.716 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.65 -41.68 95.48 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 111.416 176.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.446 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.1 tpt180 -62.71 -52.95 61.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.044 -0.526 . . . . 75.049999999999997 110.937 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 18' ' ' ALA . 86.4 mt -50.14 -48.54 53.68 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.89 -0.595 . . . . 74.010000000000005 111.998 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.43 ' HB3' ' HB ' ' A' ' 72' ' ' VAL . . . -58.78 -52.65 64.83 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.025 -0.534 . . . . 74.420000000000002 111.873 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -62.64 -35.05 78.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.601 0.593 . . . . 73.150000000000006 112.601 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.6 mm-40 -55.25 -47.69 75.06 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.251 0.548 . . . . 63.450000000000003 111.231 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -93.93 7.6 44.4 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.101 -0.499 . . . . 73.329999999999998 111.76 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.11 31.39 20.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.424 0.63 . . . . 71.310000000000002 111.559 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.5 pt -105.54 171.69 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.046 0.451 . . . . 64.340000000000003 111.23 177.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.445 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 47.8 p -97.99 143.04 28.97 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.928 0.394 . . . . 74.5 111.601 -179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.43 ' HB ' ' HB3' ' A' ' 65' ' ' ALA . 11.1 p -128.62 120.75 53.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.488 0.661 . . . . 62.140000000000001 111.986 176.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.5 p -116.09 136.01 53.42 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.761 -0.654 . . . . 75.299999999999997 110.178 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -149.39 155.07 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.014 0.746 . . . . 75.099999999999994 113.014 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 49.8 m -131.82 132.04 43.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.524 -0.762 . . . . 72.439999999999998 110.644 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.408 HD11 HH11 ' A' ' 54' ' ' ARG . 41.8 mm -94.15 122.11 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.575 0.226 . . . . 74.150000000000006 111.168 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.566 ' HG3' ' HB2' ' A' ' 2' ' ' GLU . 14.9 ptm180 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.482 0.658 . . . . 74.099999999999994 112.259 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 tmm? . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.826 0.346 . . . . 64.310000000000002 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -109.66 146.25 35.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.314 -0.403 . . . . 71.319999999999993 111.043 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.509 ' HE1' HD12 ' A' ' 5' ' ' ILE . 17.8 ptm -144.36 119.09 9.83 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.825 0.345 . . . . 75.329999999999998 111.928 -176.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.82 130.79 38.31 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.292 -0.413 . . . . 73.129999999999995 111.188 177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.509 HD12 ' HE1' ' A' ' 3' ' ' MET . 57.2 mt -132.95 112.84 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.376 -0.203 . . . . 71.239999999999995 111.38 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.409 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 51.8 mtp180 -102.73 121.74 43.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.861 0.362 . . . . 65.439999999999998 111.765 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -101.39 126.04 48.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.342 -0.39 . . . . 73.420000000000002 111.532 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -140.14 132.67 28.67 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.536 -0.302 . . . . 75.209999999999994 110.79 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.474 ' HA3' ' HB ' ' A' ' 70' ' ' ILE . . . 168.9 -173.68 43.45 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 119.977 -1.106 . . . . 75.409999999999997 114.72 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 2.5 m-20 -87.35 85.75 7.19 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.297 0.48 . . . . 65.140000000000001 112.297 -175.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 8.5 t70 178.77 164.92 0.84 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.968 0.507 . . . . 74.209999999999994 109.992 174.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.0 tp -113.76 -44.62 3.16 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.949 0.404 . . . . 75.319999999999993 111.035 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.55 -25.66 68.34 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.374 -0.376 . . . . 74.239999999999995 111.152 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.27 -29.03 30.85 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.81 0.338 . . . . 71.409999999999997 111.51 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -57.11 -60.15 4.03 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.133 0.492 . . . . 71.519999999999996 111.067 174.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 11.7 pt-20 -69.54 -38.56 77.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.319 -0.401 . . . . 72.510000000000005 111.567 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.443 ' HG3' ' HZ ' ' A' ' 68' ' ' PHE . 24.1 mmmt -56.75 -54.22 48.79 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.129999999999995 112.075 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.22 69.36 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.919 0.39 . . . . 72.230000000000004 111.846 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.7 -49.48 72.94 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.164 0.431 . . . . 53.399999999999999 112.164 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.0 tptp -61.37 -50.63 72.12 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.819 0.342 . . . . 75.540000000000006 111.672 -174.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -62.14 -43.82 98.0 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.0 0.37 . . . . 73.109999999999999 112.0 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -59.83 -45.38 92.56 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.631 0.253 . . . . 64.349999999999994 111.211 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.0 mt -63.26 -42.4 96.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.96 0.41 . . . . 74.010000000000005 110.918 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.28 -39.09 74.97 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.08 -0.509 . . . . 71.510000000000005 111.156 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -75.77 -50.2 15.94 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.072 0.397 . . . . 72.239999999999995 112.072 174.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.63 84.91 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.009 0.744 . . . . 75.5 113.009 -175.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.95 58.97 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.733 0.301 . . . . 73.150000000000006 111.701 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -54.86 -33.09 61.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.198 0.523 . . . . 74.510000000000005 111.073 175.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -111.91 -168.23 1.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.953 -0.567 . . . . 72.129999999999995 111.227 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 16.98 2.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.95 0.405 . . . . 73.519999999999996 111.778 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.84 108.19 2.78 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.452 -0.404 . . . . 52.299999999999997 113.331 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -82.9 135.49 34.9 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.8 -0.235 . . . . 72.140000000000001 110.988 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.6 t -113.28 125.32 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 112.256 0.465 . . . . 72.319999999999993 112.256 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 t -122.57 152.5 40.35 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.129 -0.487 . . . . 70.310000000000002 110.445 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.5 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 38.1 p90 -144.63 141.71 29.58 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.361 0.504 . . . . 71.319999999999993 112.361 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.0 p -133.91 135.8 43.85 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.287 -0.415 . . . . 71.409999999999997 111.152 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -87.58 127.56 35.26 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.596 0.236 . . . . 62.130000000000003 111.53 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -123.16 94.15 4.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.132 0.492 . . . . 74.310000000000002 111.645 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.78 -75.54 0.72 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.303 -0.475 . . . . 74.540000000000006 113.718 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -139.75 11.38 2.47 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.523 0.564 . . . . 73.129999999999995 112.523 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -137.47 159.97 40.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.392 0.615 . . . . 75.219999999999999 112.446 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 35' ' ' TYR . 58.0 tp -105.7 119.21 38.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.667 -0.697 . . . . 64.340000000000003 111.823 -179.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.5 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 29.7 mt-10 -91.18 104.14 16.74 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.459 -0.337 . . . . 64.030000000000001 111.233 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.49 109.61 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 120.691 0.281 . . . . 74.099999999999994 111.578 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 45' ' ' ARG . 31.1 ttp180 -110.93 125.99 54.25 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.076 0.465 . . . . 72.030000000000001 111.666 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.0 mt -108.12 139.53 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 116.415 -0.357 . . . . 75.129999999999995 110.808 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.8 m -120.42 130.61 54.42 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.386 0.513 . . . . 72.049999999999997 112.386 -175.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.75 40.53 45.15 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.907 0.723 . . . . 64.430000000000007 114.907 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.8 m -95.23 152.85 39.69 Favored Pre-proline 0 N--CA 1.469 0.516 0 O-C-N 122.302 -0.529 . . . . 74.530000000000001 111.592 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.464 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 11.3 Cg_endo -55.11 117.16 3.72 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.779 2.319 . . . . 74.430000000000007 112.724 176.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.39 -29.97 11.29 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.955 0.724 . . . . 72.209999999999994 112.955 -178.001 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 29.8 pt20 -76.11 -46.59 28.08 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.142 0.423 . . . . 73.409999999999997 112.142 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.464 ' HB ' ' HG2' ' A' ' 50' ' ' PRO . 58.8 t -67.61 -19.94 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-O 121.31 0.576 . . . . 72.150000000000006 110.844 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.434 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 7.0 ttp180 -46.17 -33.58 3.69 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.688 -0.687 . . . . 73.420000000000002 112.374 175.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 17.1 ptpt -60.29 -45.11 94.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.715 0.293 . . . . 72.510000000000005 111.455 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -74.84 -34.15 62.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.744 0.307 . . . . 73.540000000000006 111.18 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.36 -48.38 78.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.906 0.384 . . . . 73.049999999999997 111.248 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.04 -38.97 83.14 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.082 0.468 . . . . 70.150000000000006 110.982 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -58.77 -43.46 90.4 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.805 -0.634 . . . . 73.430000000000007 111.136 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -60.26 -42.35 95.17 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.124 -0.489 . . . . 73.5 110.996 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.446 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -53.84 -49.03 69.33 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.967 0.413 . . . . 72.510000000000005 111.618 177.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.34 -36.37 83.49 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.072 0.463 . . . . 52.229999999999997 111.259 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -69.08 -37.01 78.23 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.358 -0.383 . . . . 75.209999999999994 111.333 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 61' ' ' ALA . 79.7 mt -59.57 -44.01 93.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.277 0.56 . . . . 72.010000000000005 110.223 174.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.88 -48.55 81.29 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.78 -0.646 . . . . 64.420000000000002 111.038 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -60.58 -33.79 73.24 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.306 0.484 . . . . 72.230000000000004 112.306 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -57.56 -36.86 72.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.12 0.486 . . . . 75.099999999999994 111.049 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.443 ' HZ ' ' HG3' ' A' ' 17' ' ' LYS . 85.4 m-85 -111.05 7.06 21.34 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.204 -0.453 . . . . 74.049999999999997 111.25 177.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 55.58 28.51 11.99 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.06 0.544 . . . . 74.319999999999993 112.151 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.474 ' HB ' ' HA3' ' A' ' 9' ' ' GLY . 32.2 pt -95.18 -178.25 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 112.675 0.62 . . . . 75.109999999999999 112.675 -176.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.1 m -91.79 141.37 28.74 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.97 -0.559 . . . . 73.400000000000006 111.694 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.41 118.71 23.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.041 0.448 . . . . 63.509999999999998 111.237 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -115.22 120.84 41.05 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.266 -0.271 . . . . 64.340000000000003 110.469 177.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -127.92 137.3 52.24 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.301 0.572 . . . . 62.420000000000002 112.308 -175.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.0 m -113.74 111.67 22.18 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.001 -0.545 . . . . 71.010000000000005 110.822 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -123.03 116.01 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.725 0.297 . . . . 74.239999999999995 111.312 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 . . . . . 0 N--CA 1.47 0.537 0 C-N-CA 122.522 0.329 . . . . 75.430000000000007 110.757 179.656 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.84 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.9 mtp . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.01 0.433 . . . . 62.200000000000003 111.382 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HB3' ' HB2' ' A' ' 77' ' ' ARG . 0.6 OUTLIER -122.51 119.11 29.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.791 -0.818 . . . . 74.319999999999993 108.791 178.098 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.574 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.0 ttt -124.38 122.21 37.06 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.017 1.117 . . . . 75.510000000000005 114.017 -165.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.488 ' HB3' ' O ' ' A' ' 75' ' ' THR . 1.0 OUTLIER -89.61 123.94 34.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.314 -0.857 . . . . 72.299999999999997 110.272 171.415 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 41.0 mt -130.4 108.73 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.958 0.409 . . . . 74.5 111.257 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -109.49 108.04 18.38 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.428 0.529 . . . . 71.340000000000003 112.428 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -89.84 156.04 18.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.836 -0.62 . . . . 74.140000000000001 110.708 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.528 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 42.1 ttp180 -142.42 120.4 12.06 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.171 0.51 . . . . 73.430000000000007 111.387 171.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.94 131.53 2.38 Favored Glycine 0 CA--C 1.522 0.507 0 CA-C-N 115.826 -0.625 . . . . 40.240000000000002 112.493 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.68 -5.44 55.15 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 122.427 -0.455 . . . . 64.430000000000007 111.654 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.02 101.22 3.18 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 73.010000000000005 110.709 174.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 30.4 tp -61.97 -26.98 68.53 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.046 0.387 . . . . 74.230000000000004 112.046 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -73.44 -36.35 65.89 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.024 -0.423 . . . . 73.400000000000006 110.527 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.75 72.6 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.819 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.438 ' HE1' HD12 ' A' ' 42' ' ' LEU . 60.6 t80 -55.26 -48.17 74.38 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.114 0.483 . . . . 75.209999999999994 110.331 171.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 9.0 tm-20 -60.45 -50.42 73.66 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.824 -0.626 . . . . 75.409999999999997 110.86 176.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -56.63 -54.35 47.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.403 0.52 . . . . 75.549999999999997 112.403 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.511 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -56.17 -53.36 58.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.891 0.33 . . . . 70.200000000000003 111.891 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.48 -36.74 83.45 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.061 0.458 . . . . 73.519999999999996 110.786 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.9 tptm -59.03 -51.05 71.72 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.041 -0.527 . . . . 72.340000000000003 111.73 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.542 ' HG3' HD22 ' A' ' 64' ' ' LEU . 7.8 mm-40 -61.65 -47.52 85.0 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.913 -0.585 . . . . 75.439999999999998 111.82 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 51.3 mmm -61.88 -40.38 95.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.781 0.324 . . . . 74.310000000000002 111.301 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.0 mt -67.79 -37.58 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 120.787 0.327 . . . . 72.209999999999994 110.867 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.459 HH21 ' CD ' ' A' ' 21' ' ' GLU . 60.2 ttp85 -54.91 -42.5 72.25 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.884 0.373 . . . . 74.310000000000002 111.094 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -74.19 -48.04 31.73 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.951 0.405 . . . . 74.319999999999993 111.509 175.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.77 -46.66 71.04 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.752 0.649 . . . . 71.450000000000003 112.752 -175.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -56.4 -34.3 66.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.603 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -72.84 -32.63 65.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.072 0.463 . . . . 71.299999999999997 111.372 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.414 ' CZ ' HG13 ' A' ' 53' ' ' VAL . 24.9 m-85 -96.35 -6.28 38.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.321 -0.399 . . . . 74.349999999999994 111.854 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 62.12 27.21 16.4 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.126 0.489 . . . . 72.030000000000001 111.516 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.94 156.87 36.75 Favored Glycine 0 CA--C 1.527 0.802 0 CA-C-N 116.126 -0.488 . . . . 74.120000000000005 113.262 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 78.0 m -88.32 128.66 35.49 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.731 -0.276 . . . . 74.219999999999999 110.949 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.509 HG21 HG12 ' A' ' 46' ' ' ILE . 61.1 t -123.78 114.47 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 121.047 0.451 . . . . 75.129999999999995 112.054 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.8 t -106.53 154.4 20.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.274 -0.421 . . . . 70.430000000000007 110.464 173.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 41.1 p90 -145.67 138.08 25.66 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.094 0.473 . . . . 74.230000000000004 112.144 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.8 p -132.9 134.43 44.56 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.119 -0.491 . . . . 74.519999999999996 111.049 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.57 100.91 12.32 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.777 0.322 . . . . 72.439999999999998 111.133 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -97.61 97.58 9.17 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.828 0.346 . . . . 73.040000000000006 110.864 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 -78.04 0.13 Allowed Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.357 -0.449 . . . . 62.240000000000002 113.055 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -143.31 15.81 1.86 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.541 -0.388 . . . . 74.120000000000005 111.342 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.447 ' OD2' ' HD3' ' A' ' 8' ' ' ARG . 3.9 m-20 -107.17 128.67 54.61 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.217 -0.447 . . . . 74.450000000000003 111.211 177.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.438 HD12 ' HE1' ' A' ' 15' ' ' PHE . 46.8 tp -95.5 101.72 13.46 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.278 0.561 . . . . 73.25 111.358 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.584 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.7 tt0 -89.53 107.18 18.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.108 -0.497 . . . . 74.530000000000001 111.642 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.8 mt -113.07 117.62 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 122.624 0.369 . . . . 73.329999999999998 110.88 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.461 ' HG2' ' HA ' ' A' ' 4' ' ' ASP . 74.0 mtt180 -116.86 122.92 45.75 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.823 -0.548 . . . . 75.040000000000006 111.865 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.509 HG12 HG21 ' A' ' 33' ' ' VAL . 51.2 mt -110.0 115.06 48.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.995 -0.548 . . . . 73.230000000000004 111.593 -176.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.415 HG23 ' HG2' ' A' ' 2' ' ' GLU . 60.4 m -100.48 127.01 46.94 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.116 -0.493 . . . . 74.230000000000004 111.548 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.43 57.29 1.13 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 121.152 -0.547 . . . . 62.439999999999998 113.627 175.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.483 HG22 ' HB2' ' A' ' 1' ' ' MET . 18.5 m -118.11 138.73 25.81 Favored Pre-proline 0 CA--C 1.541 0.63 0 CA-C-O 120.748 0.309 . . . . 71.319999999999993 111.445 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 16.8 Cg_exo -68.14 140.46 49.49 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.008 2.472 . . . . 75.430000000000007 113.389 -177.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.84 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 11.6 pt-20 -54.64 -41.08 69.63 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.73 0.641 . . . . 54.140000000000001 112.73 -178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -66.14 -24.09 66.6 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.271 0.471 . . . . 74.530000000000001 112.271 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.518 HG12 ' HG ' ' A' ' 57' ' ' LEU . 40.1 t -84.53 -10.19 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-O 120.912 0.387 . . . . 75.040000000000006 111.684 -177.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -43.73 -45.17 6.99 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.641 0.377 . . . . 75.25 111.989 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.96 -31.44 72.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.157 -0.474 . . . . 74.200000000000003 111.836 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -77.07 -53.85 7.27 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.873 0.368 . . . . 70.510000000000005 111.694 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.518 ' HG ' HG12 ' A' ' 53' ' ' VAL . 82.5 mt -56.0 -53.52 55.9 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.582 0.586 . . . . 75.430000000000007 112.582 -174.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.18 -40.6 94.5 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.966 0.413 . . . . 72.319999999999993 111.51 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -62.66 -40.94 98.62 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.319 -0.4 . . . . 73.319999999999993 111.539 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -74.2 -34.8 63.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.826 0.346 . . . . 75.310000000000002 111.262 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.71 -47.49 85.43 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.911 0.386 . . . . 72.140000000000001 110.879 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.48 -31.47 71.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.43 -0.35 . . . . 73.120000000000005 111.34 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -55.59 -53.37 57.35 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.981 -0.377 . . . . 74.420000000000002 109.981 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.542 HD22 ' HG3' ' A' ' 21' ' ' GLU . 54.4 mt -49.87 -43.08 49.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.925 -0.579 . . . . 74.420000000000002 112.047 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -57.39 12.88 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.001 0.429 . . . . 70.439999999999998 111.577 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -69.6 -28.21 65.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 120.999 0.428 . . . . 62.119999999999997 111.828 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.73 -36.99 59.78 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.07 0.548 . . . . 74.219999999999999 111.805 -176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -111.56 7.49 20.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 120.896 0.379 . . . . 75.450000000000003 111.883 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 66.24 13.38 9.14 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.36 0.664 . . . . 75.319999999999993 112.088 176.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.7 pt -88.64 178.26 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 116.55 -0.295 . . . . 74.510000000000005 111.186 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.528 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 57.0 p -107.1 156.06 19.19 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.063 0.459 . . . . 72.129999999999995 112.144 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.78 131.8 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 121.35 0.595 . . . . 71.150000000000006 111.686 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.8 p -132.05 121.76 24.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.154 -0.475 . . . . 73.019999999999996 110.072 174.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -129.49 130.06 45.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.903 0.705 . . . . 73.400000000000006 112.903 -176.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.488 ' O ' ' HB3' ' A' ' 4' ' ' ASP . 68.3 m -113.84 121.91 45.45 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.683 -0.689 . . . . 75.099999999999994 110.783 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.574 HG12 ' HG3' ' A' ' 3' ' ' MET . 25.1 mt -101.08 126.83 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.128 0.49 . . . . 72.319999999999993 112.306 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.473 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 26.0 mmm180 . . . . . 0 CA--C 1.539 0.549 0 CA-C-N 116.129 -0.487 . . . . 71.219999999999999 110.917 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.578 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 69.3 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.836 0.351 . . . . 70.299999999999997 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.709 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 40.2 mt-10 -95.2 132.92 39.63 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 109.711 -0.477 . . . . 72.340000000000003 109.711 170.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.535 ' HE1' HD11 ' A' ' 5' ' ' ILE . 23.8 ttt -114.49 106.54 14.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.988 0.423 . . . . 70.430000000000007 110.23 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.476 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 12.5 t70 -99.67 108.44 20.8 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.197 -0.456 . . . . 38.079999999999998 111.241 -172.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.535 HD11 ' HE1' ' A' ' 3' ' ' MET . 58.6 mt -127.83 111.81 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 116.426 -0.352 . . . . 74.219999999999999 110.654 177.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -118.32 119.79 35.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.343 0.592 . . . . 75.510000000000005 112.265 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -94.17 155.53 17.01 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.802 -0.635 . . . . 73.209999999999994 111.237 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -124.13 120.02 31.13 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.888 0.375 . . . . 75.140000000000001 110.192 168.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.9 135.36 10.71 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.945 -0.645 . . . . 74.209999999999994 113.306 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.41 -43.68 59.97 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.849 0.357 . . . . 72.140000000000001 111.667 177.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -88.58 -171.48 3.35 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.067 0.46 . . . . 74.230000000000004 112.124 -178.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 54.1 tp -95.93 -52.55 4.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.545 0.572 . . . . 74.340000000000003 112.545 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -61.58 -26.75 68.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.932 0.716 . . . . 64.439999999999998 112.932 -172.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.5 -30.98 44.01 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.978 0.418 . . . . 75.230000000000004 111.026 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -59.77 -57.8 11.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.845 -0.616 . . . . 74.030000000000001 111.365 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.59 -51.16 59.48 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.131 0.419 . . . . 75.530000000000001 112.131 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 35.8 mmtp -55.27 -54.31 45.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.435 -0.348 . . . . 75.129999999999995 111.721 -176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.72 -51.99 59.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.972 0.36 . . . . 63.25 111.972 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.477 ' HB2' HD21 ' A' ' 42' ' ' LEU . 67.2 tp -55.88 -48.53 75.41 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.369 -0.378 . . . . 72.430000000000007 111.822 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -62.35 -40.84 97.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.248 0.462 . . . . 62.140000000000001 112.248 -176.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 18.6 mm-40 -60.05 -51.56 69.1 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.624 0.25 . . . . 75.049999999999997 111.174 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.4 mtp -59.38 -44.57 92.75 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.019 0.438 . . . . 74.310000000000002 111.268 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 54.0 mt -60.37 -37.15 73.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.407 -0.36 . . . . 74.230000000000004 111.219 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -57.73 -53.38 58.89 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 111.397 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -68.55 -41.61 79.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.852 0.316 . . . . 63.140000000000001 111.852 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.5 96.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.736 0.643 . . . . 74.439999999999998 112.736 -176.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 27' ' ' ARG . 28.5 mtp85 -60.04 -27.53 67.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.626 0.602 . . . . 74.209999999999994 112.626 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -58.16 -23.95 57.14 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.399 0.618 . . . . 75.239999999999995 110.965 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -114.21 -164.6 0.94 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.949 -0.569 . . . . 72.219999999999999 110.706 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.11 9.83 11.65 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.88 0.371 . . . . 53.219999999999999 111.599 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.25 86.95 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 CA-C-N 116.198 -0.456 . . . . 71.439999999999998 113.589 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 m -71.55 117.03 12.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.806 0.336 . . . . 71.530000000000001 110.963 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.457 HG22 HG12 ' A' ' 46' ' ' ILE . 56.6 t -99.19 125.23 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.38 0.511 . . . . 64.450000000000003 112.38 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.1 t -121.14 138.53 54.16 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.302 -0.408 . . . . 75.120000000000005 110.799 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.2 p90 -134.19 137.15 44.22 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.366 0.506 . . . . 75.049999999999997 112.366 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 p -124.35 138.96 54.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.198 -0.455 . . . . 72.129999999999995 111.187 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -108.08 131.6 54.43 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.045 0.45 . . . . 74.329999999999998 111.918 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -145.01 119.96 9.99 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.294 -0.412 . . . . 61.100000000000001 110.588 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 -86.72 0.07 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.105 -0.569 . . . . 73.510000000000005 112.99 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -144.92 10.77 1.36 Allowed 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.042 0.449 . . . . 71.329999999999998 111.45 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -95.32 122.78 38.38 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 111.514 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.477 HD21 ' HB2' ' A' ' 19' ' ' LEU . 33.6 tp -96.45 103.92 15.86 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.138 -0.483 . . . . 73.510000000000005 110.578 173.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.2 mt-10 -90.08 104.46 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.353 -0.385 . . . . 75.519999999999996 111.464 -177.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -105.24 109.46 27.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.73 0.3 . . . . 75.530000000000001 111.451 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 3' ' ' MET . 37.9 ttm180 -111.82 115.27 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.86 -0.525 . . . . 75.420000000000002 111.364 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.457 HG12 HG22 ' A' ' 33' ' ' VAL . 44.7 mt -92.99 137.03 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.508 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.9 m -125.51 125.2 42.88 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 111.862 0.319 . . . . 64.340000000000003 111.862 -175.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.16 58.93 1.91 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.362 -0.447 . . . . 72.5 114.143 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 18.5 m -117.16 144.63 34.1 Favored Pre-proline 0 N--CA 1.474 0.735 0 O-C-N 122.248 -0.56 . . . . 74.010000000000005 111.912 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.66 130.73 32.57 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.412 2.075 . . . . 75.140000000000001 111.626 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.18 -28.58 62.94 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.533 0.938 . . . . 72.349999999999994 113.533 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -68.1 -38.01 81.81 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 122.062 -0.399 . . . . 73.450000000000003 111.287 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -77.69 -27.23 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 121.129 0.49 . . . . 64.299999999999997 110.89 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.578 ' NH1' ' SD ' ' A' ' 1' ' ' MET . 50.3 ttp180 -49.0 -38.7 24.09 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.74 -0.664 . . . . 71.329999999999998 111.517 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -60.18 -49.09 79.01 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.166 -0.47 . . . . 74.400000000000006 111.751 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -66.98 -41.51 86.68 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.08 -0.509 . . . . 64.299999999999997 112.285 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.477 ' HB2' ' HE2' ' A' ' 3' ' ' MET . 93.1 mt -61.33 -42.96 99.54 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.864 0.364 . . . . 70.019999999999996 111.312 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.36 94.95 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.224 0.535 . . . . 72.439999999999998 111.138 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -67.93 -31.14 70.69 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.836 -0.62 . . . . 64.329999999999998 111.541 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.77 -33.32 70.65 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.977 0.418 . . . . 64.040000000000006 110.39 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.4 91.87 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.121 0.486 . . . . 62.119999999999997 110.925 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.95 -41.74 92.5 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.353 0.596 . . . . 73.040000000000006 110.534 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -57.16 -48.99 77.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.76 -0.654 . . . . 75.450000000000003 111.087 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.57 -40.23 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 111.392 177.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.45 -49.01 78.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.192 -0.458 . . . . 64.219999999999999 111.279 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.14 -33.82 76.92 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.938 0.399 . . . . 72.140000000000001 111.271 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.39 -55.24 29.78 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.186 -0.461 . . . . 75.109999999999999 111.489 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -93.24 2.52 56.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.272 0.471 . . . . 73.540000000000006 112.272 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m120 58.63 31.87 21.56 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.068 0.461 . . . . 74.519999999999996 111.297 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 29.2 pt -103.88 171.55 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-O 121.148 0.499 . . . . 74.230000000000004 112.004 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 97.7 m -98.49 141.37 31.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.106 -0.497 . . . . 73.310000000000002 111.301 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -147.54 142.99 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.41 -0.359 . . . . 72.450000000000003 111.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.1 p -118.71 147.88 43.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.751 0.31 . . . . 74.230000000000004 110.78 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.4 p90 -143.82 123.9 13.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.122 0.487 . . . . 73.040000000000006 111.969 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.9 m -131.81 143.61 50.32 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 116.381 -0.372 . . . . 74.150000000000006 111.4 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.31 105.66 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-O 121.197 0.522 . . . . 72.230000000000004 111.545 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.709 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 19.6 mtp180 . . . . . 0 CA--C 1.54 0.592 0 CA-C-O 121.328 0.585 . . . . 72.430000000000007 111.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tmm? . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 110.298 -0.26 . . . . 75.540000000000006 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.499 ' HG2' HG21 ' A' ' 47' ' ' THR . 36.3 mt-10 -135.88 140.99 44.53 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.864 0.466 . . . . 74.430000000000007 110.714 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.545 ' HE1' HD12 ' A' ' 5' ' ' ILE . 14.8 ptm -144.23 120.06 10.57 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.202 0.445 . . . . 74.5 112.202 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.618 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 29.4 m-20 -90.67 104.63 17.19 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.548 -0.296 . . . . 64.030000000000001 110.919 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.545 HD12 ' HE1' ' A' ' 3' ' ' MET . 24.3 mt -103.8 109.2 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.726 0.298 . . . . 63.539999999999999 110.936 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 4.8 ptp180 -108.47 125.61 51.97 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.256 0.55 . . . . 74.120000000000005 112.26 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -102.85 132.06 49.31 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.475 -0.784 . . . . 73.219999999999999 111.371 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -142.94 119.9 11.32 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.578 0.228 . . . . 71.209999999999994 110.665 174.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.86 160.28 30.22 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 120.826 -0.702 . . . . 74.450000000000003 113.312 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -86.3 89.05 7.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.968 0.414 . . . . 75.439999999999998 112.006 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -165.33 165.64 19.27 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.067 -0.515 . . . . 74.219999999999999 109.996 173.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -106.85 -52.16 2.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.673 0.273 . . . . 70.109999999999999 111.6 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.58 -25.6 62.26 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.313 0.486 . . . . 71.150000000000006 112.313 -178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.53 -30.17 40.37 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.078 0.399 . . . . 72.109999999999999 112.078 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -60.22 4.21 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.821 0.343 . . . . 71.420000000000002 111.178 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.74 -44.4 86.02 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 111.285 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.11 -56.13 26.03 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.081 -0.509 . . . . 73.239999999999995 112.084 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -44.33 96.13 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.119 0.485 . . . . 65.230000000000004 111.624 -177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.446 ' O ' HG13 ' A' ' 23' ' ' ILE . 45.0 tp -62.09 -56.16 21.69 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.93 -0.577 . . . . 74.409999999999997 111.779 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -63.09 -41.21 99.34 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.127 0.417 . . . . 65.420000000000002 112.127 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -54.97 -47.72 74.2 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.609 0.242 . . . . 72.450000000000003 111.515 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.41 ' HE2' ' CD1' ' A' ' 5' ' ' ILE . 45.0 mtp -72.77 -36.39 67.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.667 0.27 . . . . 74.400000000000006 111.552 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 19' ' ' LEU . 63.7 mt -57.29 -34.53 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.739 0.304 . . . . 75.5 111.274 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 24' ' ' ARG . 37.1 ttp180 -48.92 -46.72 43.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.304 -0.407 . . . . 74.329999999999998 111.577 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -74.46 -43.54 55.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.633 0.254 . . . . 73.019999999999996 111.297 174.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.08 -34.57 63.74 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.639 0.607 . . . . 71.510000000000005 112.639 -177.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HE ' ' HA ' ' A' ' 27' ' ' ARG . 6.5 mmp_? -60.53 -28.98 68.83 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.759 0.314 . . . . 72.299999999999997 111.65 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.407 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.61 -13.22 60.62 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.412 0.285 . . . . 72.209999999999994 111.746 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.73 151.54 28.81 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.211 0.529 . . . . 73.030000000000001 112.043 -177.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.21 57.05 1.05 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.015 0.436 . . . . 73.230000000000004 111.233 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.52 -168.26 12.98 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.344 -0.455 . . . . 70.349999999999994 113.491 -177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 95.8 m -103.83 127.83 51.3 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.619 -0.342 . . . . 73.439999999999998 111.751 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.7 t -131.84 110.84 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.756 0.312 . . . . 74.409999999999997 110.705 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.3 t -121.76 162.5 20.73 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.922 0.391 . . . . 64.239999999999995 111.767 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.585 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 30.3 p90 -156.41 139.44 15.42 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.236 -0.438 . . . . 73.409999999999997 111.083 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 t -137.09 133.75 35.71 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.573 0.582 . . . . 73.219999999999999 112.573 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.19 102.21 14.23 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.072 -0.513 . . . . 74.329999999999998 110.99 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -118.27 106.0 12.33 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.065 0.459 . . . . 73.329999999999998 111.013 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.54 -85.22 0.44 Allowed Glycine 0 CA--C 1.525 0.695 0 C-N-CA 121.208 -0.52 . . . . 55.0 112.808 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -146.14 15.39 1.33 Allowed 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.763 0.316 . . . . 74.400000000000006 111.545 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -117.66 130.28 56.26 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.47 -0.332 . . . . 71.200000000000003 110.856 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 48.8 tp -102.94 102.6 12.68 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.437 -0.347 . . . . 73.030000000000001 111.271 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.585 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 27.3 mm-40 -87.97 106.57 18.21 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.515 -0.311 . . . . 74.400000000000006 111.177 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.1 mt -111.69 110.23 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 120.557 0.218 . . . . 73.129999999999995 111.001 177.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 45' ' ' ARG . 39.3 ttt85 -107.1 122.6 46.8 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.945 -0.472 . . . . 73.420000000000002 111.721 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.5 mt -106.89 127.84 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 116.094 -0.503 . . . . 73.140000000000001 110.407 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.499 HG21 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -130.14 128.41 41.73 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.284 0.476 . . . . 73.129999999999995 112.284 -174.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.82 32.55 7.93 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 114.613 0.605 . . . . 45.0 114.613 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.67 141.44 24.65 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 117.506 0.653 . . . . 73.340000000000003 111.326 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.463 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 21.2 Cg_endo -59.14 133.62 54.21 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.797 2.331 . . . . 73.150000000000006 112.974 -178.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -59.58 -25.35 64.52 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.354 0.501 . . . . 71.420000000000002 112.354 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.463 ' HG2' ' HB2' ' A' ' 50' ' ' PRO . 29.0 pt20 -60.34 -34.09 73.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.76 0.314 . . . . 75.129999999999995 111.743 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.427 HG23 ' HG3' ' A' ' 52' ' ' GLN . 42.9 t -91.49 -24.42 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.001 0.429 . . . . 75.209999999999994 110.827 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.593 ' HD3' HD11 ' A' ' 76' ' ' ILE . 5.9 tmm_? -47.88 -41.82 25.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.016 0.527 . . . . 72.109999999999999 111.49 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -61.2 -42.51 98.72 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.872 0.368 . . . . 74.439999999999998 111.81 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -66.0 -45.39 81.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.883 0.373 . . . . 73.329999999999998 110.684 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.34 -43.68 83.61 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.143 0.497 . . . . 72.420000000000002 111.247 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -64.07 -46.21 85.32 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.072 -0.513 . . . . 72.239999999999995 111.719 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -71.64 -34.19 69.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.19 0.441 . . . . 73.25 112.19 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.95 -37.16 86.39 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.169 0.509 . . . . 70.030000000000001 109.988 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -63.51 -38.79 92.48 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.889 -0.596 . . . . 64.099999999999994 111.163 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 45.5 mt-10 -58.07 -40.89 82.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.858 0.361 . . . . 75.549999999999997 110.968 175.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -61.24 -44.43 97.26 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.653 -0.249 . . . . 74.450000000000003 111.032 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 61' ' ' ALA . 81.4 mt -50.46 -40.85 51.95 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.076 0.465 . . . . 75.439999999999998 111.127 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.483 ' HB2' HG12 ' A' ' 72' ' ' VAL . . . -65.8 -56.85 9.78 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.198 -0.455 . . . . 74.219999999999999 111.73 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.35 -23.92 67.11 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.19 -0.459 . . . . 72.019999999999996 112.087 -177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -82.44 -56.23 4.01 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.1 0.476 . . . . 74.409999999999997 111.431 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -94.05 4.61 53.66 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.153 0.427 . . . . 73.510000000000005 112.153 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 61.81 20.26 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.439 0.533 . . . . 74.209999999999994 112.439 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 23.8 pt -90.17 153.13 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 116.282 -0.417 . . . . 64.400000000000006 111.366 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.5 m -87.98 122.22 31.32 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.257 -0.277 . . . . 74.230000000000004 111.252 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.483 HG12 ' HB2' ' A' ' 65' ' ' ALA . 12.5 p -123.88 133.62 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.26 0.552 . . . . 75.349999999999994 111.591 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 p -142.62 142.02 32.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.219 -0.446 . . . . 72.530000000000001 110.713 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 13.6 p90 -137.24 128.59 28.14 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.822 0.675 . . . . 73.340000000000003 112.822 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.4 m -102.78 123.86 47.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.89 -0.596 . . . . 72.230000000000004 110.197 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.593 HD11 ' HD3' ' A' ' 54' ' ' ARG . 34.3 mt -122.99 139.46 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.78 0.659 . . . . 74.439999999999998 112.78 -169.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 77' ' ' ARG . 14.0 ptm180 . . . . . 0 N--CA 1.468 0.438 0 CA-C-N 115.982 -0.554 . . . . 75.349999999999994 110.781 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.472 ' HE2' ' HA ' ' A' ' 51' ' ' GLU . 47.8 ttp . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.562 0.22 . . . . 74.129999999999995 110.826 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -125.8 153.51 43.95 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.245 0.461 . . . . 73.319999999999993 112.245 -175.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.453 ' HE1' HD12 ' A' ' 5' ' ' ILE . 21.1 ptm -148.29 112.14 5.11 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.951 -0.568 . . . . 75.540000000000006 110.979 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.562 ' HB3' ' HG2' ' A' ' 45' ' ' ARG . 2.3 p-10 -99.11 119.8 38.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.525 0.678 . . . . 74.510000000000005 111.866 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.502 HD13 ' HB1' ' A' ' 61' ' ' ALA . 56.4 mt -111.61 114.83 48.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 115.98 -0.555 . . . . 75.329999999999998 111.576 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -101.13 112.52 25.01 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.987 0.423 . . . . 73.040000000000006 111.549 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.427 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 97.8 m-85 -91.19 156.04 18.14 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.75 0.309 . . . . 75.340000000000003 111.555 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 65.1 ttt180 -139.91 121.52 15.25 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.586 -0.279 . . . . 73.25 111.206 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.25 163.82 36.73 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.164 -0.541 . . . . 53.329999999999998 113.262 178.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -87.31 -35.74 18.25 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.946 0.403 . . . . 73.340000000000003 111.525 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.7 119.68 9.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.047 -0.524 . . . . 73.439999999999998 112.036 -177.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.95 -39.86 93.57 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.076 0.465 . . . . 71.219999999999999 110.87 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 1.8 mp0 -61.9 -27.88 69.13 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.091 -0.504 . . . . 74.329999999999998 111.744 177.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.522 ' HB2' HD12 ' A' ' 70' ' ' ILE . . . -58.97 -39.65 82.38 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.828 0.347 . . . . 75.540000000000006 111.13 177.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -67.89 -53.92 22.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.33 -0.396 . . . . 75.519999999999996 111.642 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.474 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.0 pt-20 -62.38 -42.56 99.51 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.1 0.407 . . . . 64.430000000000007 112.1 -177.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.697 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 4.2 mmmp? -65.29 -42.62 92.93 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 122.296 -0.252 . . . . 75.150000000000006 111.437 178.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.505 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -62.24 -47.54 83.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.209 0.528 . . . . 72.200000000000003 111.432 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.14 -43.99 97.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.975 -0.557 . . . . 73.340000000000003 111.146 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -60.95 -48.31 82.4 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 111.593 -178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -57.95 -53.21 60.75 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.915 0.339 . . . . 73.140000000000001 111.915 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.405 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.3 mmm -59.55 -48.6 81.03 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.774 0.321 . . . . 72.519999999999996 111.704 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.602 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.8 mt -64.64 -42.77 96.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.764 0.283 . . . . 73.0 111.764 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -51.66 -47.44 63.79 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.727 0.299 . . . . 74.140000000000001 111.666 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -72.14 -44.23 63.45 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.83 0.348 . . . . 71.409999999999997 111.315 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.57 -31.46 69.47 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.003 0.742 . . . . 74.510000000000005 113.003 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 79.5 mtp180 -58.88 -28.47 66.17 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.023 0.379 . . . . 74.150000000000006 112.023 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -70.41 -13.56 62.19 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.962 0.41 . . . . 73.109999999999999 111.391 178.366 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.13 117.72 32.01 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.454 -0.339 . . . . 74.5 110.663 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.49 87.85 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.782 0.66 . . . . 74.549999999999997 112.782 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.31 -153.8 6.23 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 112.461 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.3 m -148.09 136.0 21.02 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.758 0.313 . . . . 63.329999999999998 111.188 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.1 t -117.42 124.76 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 120.994 0.426 . . . . 75.319999999999993 111.545 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.1 t -117.79 153.54 33.27 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.389 -0.369 . . . . 74.409999999999997 110.281 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 37.6 p90 -141.8 141.93 33.18 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.61 0.596 . . . . 71.420000000000002 112.61 -173.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 17.2 m -119.18 123.36 44.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.091 -0.504 . . . . 72.25 111.14 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.46 121.54 41.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.575 0.226 . . . . 74.540000000000006 111.203 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.73 84.53 2.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.093 0.473 . . . . 71.010000000000005 111.247 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.53 -91.84 0.04 OUTLIER Glycine 0 CA--C 1.532 1.11 0 CA-C-N 116.226 -0.443 . . . . 45.149999999999999 113.56 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 17.7 m-80 -95.91 -15.04 22.66 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 122.548 -0.383 . . . . 74.329999999999998 111.609 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -97.83 149.41 22.39 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.766 0.654 . . . . 74.5 112.766 -173.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.427 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 38.0 tp -138.82 100.7 4.12 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.451 -0.795 . . . . 65.099999999999994 110.671 175.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.487 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 38.2 tt0 -89.78 104.37 16.94 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.56 -0.291 . . . . 75.230000000000004 111.387 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.75 108.72 24.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.964 0.412 . . . . 65.329999999999998 111.08 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.562 ' HG2' ' HB3' ' A' ' 4' ' ' ASP . 94.1 mtt180 -97.82 108.91 21.72 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.743 0.306 . . . . 71.430000000000007 111.384 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.6 mt -94.48 121.94 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.76 0.314 . . . . 75.450000000000003 110.803 177.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.3 m -119.06 127.97 53.91 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.859 0.318 . . . . 75.329999999999998 111.859 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.91 61.79 1.26 Allowed Glycine 0 CA--C 1.527 0.837 0 C-N-CA 121.141 -0.552 . . . . 60.009999999999998 113.929 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.81 146.52 61.69 Favored Pre-proline 0 CA--C 1.542 0.669 0 O-C-N 122.504 -0.409 . . . . 75.150000000000006 111.554 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.73 137.59 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.514 2.143 . . . . 71.340000000000003 112.446 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.472 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 36.4 tt0 -55.69 -36.73 67.47 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.879 0.696 . . . . 73.099999999999994 112.879 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.06 -30.58 68.17 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.041 0.448 . . . . 75.549999999999997 111.529 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.453 HG13 ' HG ' ' A' ' 57' ' ' LEU . 59.7 t -92.66 -32.33 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.515 -0.312 . . . . 73.549999999999997 111.281 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.51 ' HD2' HG23 ' A' ' 76' ' ' ILE . 46.4 ttp180 -47.22 -39.5 14.26 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.257 0.551 . . . . 73.209999999999994 111.338 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -52.9 -49.06 66.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.55 -0.75 . . . . 74.329999999999998 111.432 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.11 -34.87 59.48 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.114 -0.494 . . . . 74.420000000000002 111.556 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.453 ' HG ' HG13 ' A' ' 53' ' ' VAL . 93.9 mt -61.23 -33.33 73.32 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.027 0.441 . . . . 74.019999999999996 111.198 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.54 -39.08 88.4 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.017 0.437 . . . . 63.240000000000002 110.845 174.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -70.95 -29.55 65.59 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.35 -0.386 . . . . 72.530000000000001 111.638 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.77 -38.21 66.95 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.911 0.386 . . . . 71.209999999999994 110.523 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.508 ' HB2' HG21 ' A' ' 72' ' ' VAL . . . -58.22 -44.04 87.98 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.129 -0.487 . . . . 75.349999999999994 111.053 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.05 -41.46 97.38 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.244 -0.435 . . . . 75.530000000000001 111.146 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -63.21 -44.29 95.73 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.202 -0.454 . . . . 71.310000000000002 110.867 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 18' ' ' ALA . 96.2 mt -63.05 -37.18 86.18 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.084 -0.507 . . . . 74.200000000000003 111.606 178.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.19 77.89 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.197 0.522 . . . . 70.299999999999997 110.703 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.84 -25.93 63.97 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.039 -0.528 . . . . 74.319999999999993 111.687 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.12 -53.1 62.08 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.125 0.488 . . . . 61.439999999999998 111.367 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -110.52 16.64 21.41 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.05 0.389 . . . . 73.239999999999995 112.05 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 60.6 23.8 13.55 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.896 0.379 . . . . 74.040000000000006 111.917 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.522 HD12 ' HB2' ' A' ' 14' ' ' ALA . 31.2 pt -91.13 179.22 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.219 0.533 . . . . 64.120000000000005 111.933 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.5 m -101.33 149.86 23.6 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.208 -0.451 . . . . 71.310000000000002 111.223 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.508 HG21 ' HB2' ' A' ' 61' ' ' ALA . 11.2 p -144.92 133.85 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.423 0.63 . . . . 74.010000000000005 112.615 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -133.07 128.56 36.48 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.766 -0.652 . . . . 65.049999999999997 110.137 173.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -128.22 153.17 47.22 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.645 0.609 . . . . 72.329999999999998 112.645 -175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.3 m -127.49 132.69 49.94 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.846 -0.616 . . . . 44.43 110.737 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.51 HG23 ' HD2' ' A' ' 54' ' ' ARG . 39.5 mt -121.48 110.12 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.167 0.508 . . . . 72.150000000000006 111.564 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.3 ptm85 . . . . . 0 CA--C 1.537 0.458 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 111.35 -178.866 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.405 ' HG2' ' N ' ' A' ' 2' ' ' GLU . 41.0 ttp . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.944 0.402 . . . . 74.040000000000006 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.405 ' N ' ' HG2' ' A' ' 1' ' ' MET . 29.9 mt-10 -100.04 147.0 26.09 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.196 -0.456 . . . . 55.530000000000001 110.293 173.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.456 ' HA ' HG12 ' A' ' 76' ' ' ILE . 21.7 ttt -148.36 108.25 4.03 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.11 0.481 . . . . 62.310000000000002 112.076 177.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.469 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 8.3 m-20 -92.97 110.15 21.61 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.116 -0.493 . . . . 73.439999999999998 110.627 174.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -115.6 116.88 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.739 -0.209 . . . . 72.519999999999996 110.78 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 72' ' ' VAL . 1.8 ptp85 -105.76 128.51 53.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.338 0.496 . . . . 62.439999999999998 112.338 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -105.06 126.04 51.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.756 -0.656 . . . . 75.319999999999993 109.665 172.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -117.03 121.95 42.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.755 0.312 . . . . 74.230000000000004 111.238 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.52 157.97 19.58 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 116.043 -0.526 . . . . 65.329999999999998 112.346 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -93.46 -10.45 34.98 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.572 0.582 . . . . 70.140000000000001 112.572 -177.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.35 109.29 2.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.163 0.506 . . . . 71.319999999999993 111.369 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.2 tp -49.19 -55.51 12.24 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.31 0.855 . . . . 62.399999999999999 113.31 -174.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.3 69.17 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.311 0.486 . . . . 65.209999999999994 112.311 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.65 67.95 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.928 0.394 . . . . 74.219999999999999 111.046 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.42 ' CD1' HD23 ' A' ' 42' ' ' LEU . 64.5 t80 -53.6 -52.05 61.07 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.896 -0.593 . . . . 62.450000000000003 111.0 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -69.38 -54.21 15.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.761 -0.654 . . . . 74.209999999999994 111.983 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -55.91 -46.74 78.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.374 0.509 . . . . 72.310000000000002 112.374 -174.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.57 -54.7 11.04 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.887 0.329 . . . . 71.430000000000007 111.887 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.6 tp -55.91 -39.27 71.38 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.848 0.356 . . . . 70.140000000000001 111.508 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.09 -39.61 95.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.56 -0.291 . . . . 75.349999999999994 111.506 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -68.81 -41.56 78.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.725 0.298 . . . . 74.540000000000006 111.313 177.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 87.7 mmm -59.99 -47.61 85.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.001 0.429 . . . . 74.430000000000007 110.949 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.48 -44.64 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-N 116.203 -0.453 . . . . 72.109999999999999 110.978 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -49.62 -50.7 41.9 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.261 0.624 . . . . 74.129999999999995 111.964 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.535 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 2.8 mp0 -70.96 -41.21 71.39 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.31 -0.405 . . . . 75.430000000000007 111.739 178.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -33.62 74.34 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.34 0.496 . . . . 53.030000000000001 112.34 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -28.86 69.54 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.03 0.382 . . . . 73.150000000000006 112.03 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.669 ' HB2' ' HZ3' ' A' ' 28' ' ' LYS . 10.4 mtmp? -70.22 -13.94 62.4 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.063 0.458 . . . . 75.129999999999995 111.147 175.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -120.28 -172.25 2.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.095 -0.502 . . . . 73.049999999999997 110.559 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -94.51 36.2 1.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.172 0.51 . . . . 72.030000000000001 110.888 174.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.12 122.71 5.84 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-N 116.232 -0.44 . . . . 73.430000000000007 113.867 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.1 m -87.71 118.0 26.92 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.571 -0.37 . . . . 73.439999999999998 110.632 175.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.2 t -105.1 137.57 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.247 0.546 . . . . 75.409999999999997 112.291 -175.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 t -152.17 167.67 27.79 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.75 -0.659 . . . . 70.140000000000001 110.297 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -156.16 158.18 37.21 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.361 0.601 . . . . 75.129999999999995 112.345 -175.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 t -132.71 133.64 43.76 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.844 -0.616 . . . . 64.540000000000006 110.846 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.23 138.39 34.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.057 0.456 . . . . 73.349999999999994 111.814 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -143.44 89.6 2.09 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.223 0.535 . . . . 70.219999999999999 110.555 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.74 -99.34 0.47 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.13 -0.486 . . . . 42.210000000000001 112.503 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -114.14 12.8 17.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 120.883 0.373 . . . . 73.409999999999997 111.243 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -104.26 130.24 52.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.815 0.341 . . . . 55.119999999999997 111.26 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 47.8 tp -120.67 96.35 5.09 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.321 -0.4 . . . . 73.209999999999994 111.279 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -87.64 109.11 19.43 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.808 0.337 . . . . 70.439999999999998 110.832 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.7 mt -101.74 115.21 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 120.83 0.348 . . . . 72.329999999999998 111.925 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.52 ' HD2' ' OG1' ' A' ' 47' ' ' THR . 0.8 OUTLIER -95.45 121.26 36.94 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.189 0.519 . . . . 73.340000000000003 111.146 175.938 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.473 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 47.1 mt -121.18 113.59 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.701 173.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.52 ' OG1' ' HD2' ' A' ' 45' ' ' ARG . 63.7 m -105.39 133.69 49.73 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.732 0.301 . . . . 73.219999999999999 111.365 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.84 -10.69 18.37 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.899 -0.667 . . . . 63.219999999999999 113.747 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.456 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 22.5 m -63.49 133.9 95.67 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 116.926 0.363 . . . . 74.430000000000007 111.689 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 14.3 Cg_exo -69.34 147.64 66.04 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.757 2.305 . . . . 73.319999999999993 113.616 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -46.68 -52.7 13.24 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.814 -0.63 . . . . 64.439999999999998 112.46 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -58.94 -29.88 67.45 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.487 0.551 . . . . 74.129999999999995 112.487 -177.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.533 HG12 ' HG ' ' A' ' 57' ' ' LEU . 42.6 t -79.29 -16.13 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 120.789 0.328 . . . . 74.319999999999993 111.652 -176.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.622 ' NH1' ' HB1' ' A' ' 58' ' ' ALA . 46.0 tpt85 -46.63 -37.87 8.82 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.104 0.562 . . . . 75.349999999999994 111.917 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -65.91 -54.86 21.04 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.472 -0.785 . . . . 74.5 111.94 -177.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -64.28 -37.18 86.59 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.959 0.355 . . . . 73.340000000000003 111.959 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HG ' HG12 ' A' ' 53' ' ' VAL . 95.9 mt -60.34 -45.09 94.69 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.865 0.364 . . . . 65.109999999999999 111.458 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.622 ' HB1' ' NH1' ' A' ' 54' ' ' ARG . . . -63.78 -45.65 88.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.103 0.478 . . . . 73.409999999999997 111.462 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -64.29 -31.76 73.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.035 -0.53 . . . . 74.409999999999997 111.316 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -72.69 -48.53 38.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.309 -0.405 . . . . 53.439999999999998 111.017 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.73 -42.32 71.43 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.22 0.452 . . . . 72.150000000000006 112.22 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.23 -48.7 78.14 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.734 0.302 . . . . 72.140000000000001 111.47 176.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -63.13 -37.07 85.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.272 -0.422 . . . . 73.400000000000006 110.823 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.66 -43.6 96.25 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.99 0.424 . . . . 72.209999999999994 111.612 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.06 14.43 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.18 0.437 . . . . 70.010000000000005 112.18 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -62.47 -30.7 71.44 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.033 0.382 . . . . 73.099999999999994 112.033 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -53.56 -39.5 64.82 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.837 0.351 . . . . 73.129999999999995 111.229 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -112.24 12.65 20.37 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 111.855 0.317 . . . . 73.219999999999999 111.855 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.3 t30 59.75 23.86 12.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.241 0.543 . . . . 60.210000000000001 111.898 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 32.1 pt -93.5 170.16 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.829 -0.544 . . . . 75.510000000000005 111.45 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.7 m -94.84 148.26 22.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 116.531 -0.304 . . . . 75.329999999999998 111.713 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 13.6 p -146.72 133.25 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 120.996 0.427 . . . . 75.409999999999997 111.997 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.6 p -132.67 167.6 19.79 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 122.161 -0.337 . . . . 64.430000000000007 110.988 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -125.35 146.23 49.67 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.948 0.404 . . . . 72.019999999999996 111.908 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.469 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 99.0 m -140.22 122.82 16.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.269 -0.423 . . . . 74.510000000000005 110.654 174.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 3' ' ' MET . 66.0 mt -134.2 132.12 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 112.031 0.382 . . . . 72.349999999999994 112.031 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.3 mtm180 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 109.839 -0.43 . . . . 75.129999999999995 109.839 172.563 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.946 0.403 . . . . 72.319999999999993 110.711 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.529 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 2.3 tm-20 -137.49 130.99 31.19 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.926 -0.398 . . . . 74.409999999999997 109.926 -175.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.529 ' SD ' HG13 ' A' ' 76' ' ' ILE . 12.8 tpt -115.89 120.3 38.77 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.955 1.095 . . . . 74.409999999999997 113.955 -161.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -97.87 120.67 38.67 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 116.471 -0.331 . . . . 72.109999999999999 110.777 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.07 140.04 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-O 120.822 0.344 . . . . 73.299999999999997 111.028 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.412 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 67.0 mtt85 -137.89 121.7 17.6 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.951 -0.468 . . . . 74.099999999999994 112.001 -178.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.33 144.9 28.79 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.94 0.4 . . . . 64.420000000000002 111.61 178.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.435 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 43.7 ttm180 -143.06 131.48 22.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.388 -0.369 . . . . 65.420000000000002 110.613 174.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 168.53 -145.94 9.98 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 119.845 -1.169 . . . . 73.209999999999994 114.355 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 28.3 t70 -139.36 174.14 10.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 122.528 0.331 . . . . 72.200000000000003 111.138 -175.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.423 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 26.8 t70 84.89 137.11 0.05 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 74.129999999999995 112.103 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.8 -49.07 61.63 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.013 -0.54 . . . . 73.319999999999993 111.743 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.554 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 44.8 mt-10 -59.95 -34.35 73.14 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.609 0.242 . . . . 73.310000000000002 111.227 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.75 -44.4 69.93 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.933 0.397 . . . . 72.430000000000007 110.734 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.78 -60.28 3.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.213 -0.449 . . . . 74.530000000000001 111.912 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 9.3 pt-20 -65.36 -41.86 93.4 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.647 0.61 . . . . 75.409999999999997 112.647 -172.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -71.69 -46.58 58.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.219 -0.301 . . . . 73.430000000000007 111.6 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -61.17 -48.93 79.28 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.86 0.362 . . . . 73.450000000000003 111.027 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.435 ' O ' HG13 ' A' ' 23' ' ' ILE . 59.6 tp -58.33 -44.14 88.53 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.436 -0.347 . . . . 64.450000000000003 110.908 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.05 -47.75 80.19 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.476 -0.329 . . . . 72.239999999999995 111.68 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 21.9 mm-40 -58.94 -38.7 79.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.821 0.343 . . . . 54.43 111.592 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 86.9 mmm -67.64 -37.94 83.13 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.675 0.274 . . . . 74.019999999999996 111.036 176.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 19' ' ' LEU . 76.4 mt -64.7 -40.16 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.1 0.476 . . . . 73.519999999999996 110.569 174.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -57.57 -41.7 81.61 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.204 0.526 . . . . 74.099999999999994 110.663 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 21' ' ' GLU . 68.2 mt-30 -66.06 -45.16 82.31 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.149 -0.478 . . . . 75.420000000000002 110.636 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.42 65.71 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.763 -0.653 . . . . 65.049999999999997 112.701 -178.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 10.3 mmm180 -63.13 -29.21 70.62 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.834 0.349 . . . . 71.25 111.422 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.4 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 26.4 mmmt -79.81 -18.33 51.18 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.058 0.392 . . . . 62.450000000000003 112.058 178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -94.38 125.42 39.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.964 0.411 . . . . 71.319999999999993 111.704 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.06 59.17 2.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.181 0.515 . . . . 73.209999999999994 111.223 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.78 -136.88 2.59 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 115.99 -0.55 . . . . 62.25 113.05 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.1 m -142.68 139.21 31.08 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.919 0.34 . . . . 74.319999999999993 111.919 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.537 HG22 HG22 ' A' ' 46' ' ' ILE . 98.3 t -121.65 137.1 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 121.013 0.435 . . . . 71.400000000000006 111.608 178.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.3 p -117.58 150.84 38.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.052 -0.522 . . . . 72.340000000000003 111.003 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.9 p90 -155.88 131.95 9.99 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.203 0.525 . . . . 72.209999999999994 112.383 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 t -137.29 139.62 41.03 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.16 -0.473 . . . . 74.129999999999995 111.465 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.1 140.67 29.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.904 0.383 . . . . 64.230000000000004 111.788 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -141.81 86.95 2.02 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.157 0.503 . . . . 73.239999999999995 110.6 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.98 -94.93 0.15 Allowed Glycine 0 CA--C 1.524 0.649 0 CA-C-N 116.19 -0.459 . . . . 71.409999999999997 112.972 -178.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -107.68 -7.34 16.45 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.754 0.312 . . . . 74.109999999999999 111.116 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -93.71 150.92 20.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.244 0.545 . . . . 71.409999999999997 111.812 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.43 ' HG ' HG13 ' A' ' 44' ' ' ILE . 29.8 tp -138.39 102.21 4.57 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.846 -0.616 . . . . 71.25 110.898 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.643 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 36.3 mm-40 -78.18 111.23 13.9 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.027 -0.533 . . . . 63.509999999999998 111.026 178.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.43 HG13 ' HG ' ' A' ' 42' ' ' LEU . 62.8 mt -122.03 109.79 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.053 0.454 . . . . 74.420000000000002 111.24 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -112.71 127.16 56.05 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.993 0.425 . . . . 72.5 110.995 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.537 HG22 HG22 ' A' ' 33' ' ' VAL . 54.7 mt -111.34 109.77 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.092 0.473 . . . . 74.530000000000001 111.047 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.529 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 89.4 m -98.68 109.26 22.04 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.083 -0.508 . . . . 72.549999999999997 111.546 -177.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.69 67.23 0.57 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 121.404 -0.427 . . . . 71.120000000000005 113.312 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 m -122.13 143.2 38.44 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 112.069 0.396 . . . . 73.409999999999997 112.069 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.35 146.25 44.78 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.752 2.302 . . . . 74.140000000000001 112.597 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -54.89 -46.92 74.85 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.916 0.389 . . . . 61.130000000000003 111.967 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.07 -22.06 60.16 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.463 0.542 . . . . 74.510000000000005 112.463 -177.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.466 HG12 ' HG ' ' A' ' 57' ' ' LEU . 48.6 t -85.92 -6.45 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-O 121.085 0.469 . . . . 74.530000000000001 111.488 -178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HD3' HD13 ' A' ' 76' ' ' ILE . 47.6 tpt85 -50.28 -44.42 53.83 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 111.984 0.365 . . . . 70.530000000000001 111.984 176.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -63.5 -40.72 97.82 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.494 -0.321 . . . . 73.310000000000002 111.326 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.24 -51.89 61.39 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.358 -0.383 . . . . 73.129999999999995 111.169 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.3 mt -53.16 -49.37 66.78 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.876 0.37 . . . . 74.299999999999997 111.811 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.75 -51.12 52.83 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.999 0.428 . . . . 61.43 111.822 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -58.43 -42.63 87.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.955 -0.566 . . . . 72.420000000000002 112.257 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.602 ' HG3' HH21 ' A' ' 63' ' ' ARG . 0.4 OUTLIER -70.43 -43.29 70.25 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.235 -0.439 . . . . 75.510000000000005 111.783 178.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.88 82.69 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.042 0.449 . . . . 74.420000000000002 111.314 176.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 45.1 mt-10 -61.66 -43.64 98.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.265 -0.425 . . . . 65.230000000000004 111.112 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.602 HH21 ' HG3' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -55.97 -44.16 78.25 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.883 0.373 . . . . 72.230000000000004 111.227 176.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 96.2 mt -60.32 -48.87 79.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.0 0.429 . . . . 73.329999999999998 111.09 176.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.59 -52.33 65.87 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.151 -0.477 . . . . 72.099999999999994 112.023 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.701 ' HZ1' ' HB3' ' A' ' 66' ' ' LYS . 7.7 mtpm? -61.63 -44.67 96.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.28 -0.418 . . . . 75.099999999999994 112.033 -177.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.0 -34.2 73.01 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 120.83 0.348 . . . . 60.530000000000001 111.898 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.1 7.76 36.37 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.259 0.466 . . . . 73.409999999999997 112.259 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 58.68 30.98 20.65 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.468 0.544 . . . . 74.019999999999996 112.468 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.6 pt -109.6 177.13 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.009 0.433 . . . . 73.329999999999998 111.728 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.435 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 55.4 p -102.62 153.4 20.14 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.119 0.485 . . . . 72.019999999999996 111.921 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -152.11 141.56 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.128 0.489 . . . . 74.439999999999998 111.628 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.412 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 74.4 p -118.55 141.21 48.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.253 -0.43 . . . . 63.530000000000001 110.079 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -140.86 120.06 12.93 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.55 -0.296 . . . . 71.430000000000007 111.002 -176.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.0 m -153.58 116.71 4.56 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.446 0.535 . . . . 74.319999999999993 112.446 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.529 HG13 ' SD ' ' A' ' 3' ' ' MET . 29.1 mt -76.96 141.76 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.491 -0.322 . . . . 73.129999999999995 110.408 171.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 122.066 0.936 . . . . 71.230000000000004 110.999 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.505 ' HE3' ' HG3' ' A' ' 54' ' ' ARG . 44.7 ttp . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.475 0.178 . . . . 74.530000000000001 110.553 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -124.38 164.08 20.41 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.971 0.415 . . . . 62.109999999999999 111.373 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt -148.43 118.84 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.789 0.328 . . . . 74.340000000000003 111.828 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.413 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 37.0 m-20 -94.81 104.77 16.68 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.779 0.324 . . . . 65.310000000000002 111.487 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.1 mt -105.12 146.45 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 122.33 0.252 . . . . 73.420000000000002 110.518 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.475 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 5.9 ptm180 -144.16 118.25 9.47 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.509 0.671 . . . . 75.239999999999995 111.882 175.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -90.41 149.88 22.08 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.774 -0.648 . . . . 64.319999999999993 110.331 174.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.74 120.38 12.55 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.701 0.286 . . . . 72.329999999999998 110.431 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.12 -164.83 36.21 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 121.065 -0.588 . . . . 53.130000000000003 113.143 -177.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -118.37 -24.48 6.85 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.21 0.448 . . . . 73.150000000000006 112.21 -176.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.9 118.32 6.55 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.562 . . . . 71.340000000000003 112.516 -173.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -67.59 -43.59 80.17 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.067 -0.515 . . . . 71.519999999999996 111.741 -178.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 3.5 mp0 -53.97 -30.63 47.78 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.0 0.371 . . . . 62.420000000000002 112.0 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.22 -40.36 70.75 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.488 -0.324 . . . . 74.319999999999993 111.713 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.458 ' O ' ' HB3' ' A' ' 19' ' ' LEU . 84.3 t80 -53.42 -57.23 11.37 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.306 -0.406 . . . . 72.010000000000005 111.429 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -65.38 -57.22 8.88 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.83 0.348 . . . . 74.239999999999995 111.625 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 72.8 mmtt -59.77 -47.34 86.07 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.383 0.512 . . . . 74.329999999999998 112.383 -170.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.454 ' HB3' HD11 ' A' ' 64' ' ' LEU . . . -75.0 -58.71 3.12 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.547 0.573 . . . . 73.409999999999997 112.547 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.458 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 67.7 tp -61.86 -53.29 57.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.194 0.442 . . . . 73.019999999999996 112.194 -173.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -60.56 -33.27 72.45 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.15 0.5 . . . . 74.140000000000001 110.755 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.492 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 16.1 tp10 -66.78 -44.2 81.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.33 0.652 . . . . 64.120000000000005 111.029 176.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.53 -44.61 90.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.994 0.425 . . . . 71.239999999999995 111.315 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.545 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.0 mt -61.15 -39.7 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.905 0.383 . . . . 75.549999999999997 110.782 175.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 52.3 ttt180 -49.38 -53.84 20.4 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.933 -0.576 . . . . 71.420000000000002 111.421 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.47 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 2.8 mp0 -61.04 -42.64 98.86 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.856 0.36 . . . . 74.310000000000002 111.273 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.37 -25.33 64.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.059 0.392 . . . . 74.439999999999998 112.059 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 3.9 mmp_? -77.96 -30.01 50.12 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.733 0.301 . . . . 74.430000000000007 111.529 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.47 ' HE2' ' HA ' ' A' ' 25' ' ' GLN . 54.1 mtmt -75.21 -35.84 61.45 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.015 0.436 . . . . 73.329999999999998 110.863 175.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -90.4 -173.38 3.77 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.291 -0.413 . . . . 74.510000000000005 110.851 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.38 10.73 38.86 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.058 -0.401 . . . . 65.030000000000001 111.848 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -84.33 170.36 46.7 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 121.129 -0.558 . . . . 74.510000000000005 113.457 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 85.7 m -134.22 136.22 43.53 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.428 -0.454 . . . . 75.439999999999998 111.3 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.457 HG22 HG12 ' A' ' 46' ' ' ILE . 95.4 t -109.92 123.92 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.0 0.429 . . . . 73.230000000000004 111.973 -178.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 t -117.15 158.93 23.4 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.442 -0.345 . . . . 74.310000000000002 110.664 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -155.07 143.8 20.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.928 0.394 . . . . 63.299999999999997 112.035 -174.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -126.6 129.94 49.53 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.001 0.429 . . . . 73.510000000000005 111.419 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.429 HD23 ' HE1' ' A' ' 15' ' ' PHE . 4.0 mm? -89.68 133.62 34.56 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 111.069 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.442 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 12.1 t70 -138.3 81.02 1.83 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.349 -0.387 . . . . 72.400000000000006 110.488 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.51 -85.79 0.03 OUTLIER Glycine 0 CA--C 1.532 1.103 0 C-N-CA 121.428 -0.415 . . . . 72.140000000000001 113.634 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -117.0 9.43 13.68 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.989 0.423 . . . . 72.129999999999995 111.504 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.442 ' HB2' ' HB3' ' A' ' 38' ' ' ASP . 5.8 m-20 -112.66 128.75 56.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.295 -0.411 . . . . 74.310000000000002 111.553 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.46 95.61 5.04 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.112 0.482 . . . . 75.299999999999997 110.331 174.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.475 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 32.4 mt-10 -93.5 112.15 23.98 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.261 0.553 . . . . 75.209999999999994 111.576 -176.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.9 mt -109.38 111.73 37.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-N 115.752 -0.658 . . . . 72.510000000000005 111.988 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.468 HH12 ' HD2' ' A' ' 77' ' ' ARG . 51.4 ttt85 -101.85 128.18 48.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.903 0.383 . . . . 74.349999999999994 111.315 178.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.457 HG12 HG22 ' A' ' 33' ' ' VAL . 49.3 mt -111.29 130.73 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 121.128 0.489 . . . . 74.25 111.586 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.7 m -121.08 141.01 51.19 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.246 -0.434 . . . . 75.430000000000007 111.533 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.23 46.16 5.09 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 121.247 -0.501 . . . . 51.140000000000001 113.59 177.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.8 m -125.31 139.23 33.34 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.539 -0.389 . . . . 71.420000000000002 111.539 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.42 168.86 16.13 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.807 2.338 . . . . 73.349999999999994 113.033 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.52 -48.63 74.36 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.57 0.581 . . . . 71.299999999999997 112.57 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.43 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.8 pt20 -59.72 -42.45 93.14 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.386 0.513 . . . . 71.25 112.386 -176.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.43 HG23 ' HG3' ' A' ' 52' ' ' GLN . 90.0 t -76.97 -30.91 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 120.686 0.279 . . . . 74.349999999999994 111.496 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.505 ' HG3' ' HE3' ' A' ' 1' ' ' MET . 4.1 tmm_? -55.85 -46.0 78.3 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.663 0.268 . . . . 75.319999999999993 110.576 178.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -57.16 -43.25 82.37 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.018 0.437 . . . . 71.209999999999994 111.304 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.02 -40.55 96.59 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 111.293 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.91 -41.73 97.6 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.402 -0.363 . . . . 62.439999999999998 111.171 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.29 88.41 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.123 0.487 . . . . 71.420000000000002 111.217 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -55.61 -38.2 69.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.707 -0.679 . . . . 73.319999999999993 111.029 177.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 8.9 tp10 -70.35 -52.22 24.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.02 -0.536 . . . . 74.530000000000001 110.841 176.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.467 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -52.35 -51.44 58.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.765 0.654 . . . . 72.439999999999998 112.765 -176.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.47 -37.09 72.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.958 0.408 . . . . 75.430000000000007 111.416 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -39.28 68.98 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.344 -0.389 . . . . 62.130000000000003 111.394 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 94.4 mt -56.84 -45.51 82.32 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.999 0.428 . . . . 73.340000000000003 111.184 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -64.2 -50.71 67.02 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.148 -0.478 . . . . 75.019999999999996 111.478 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.601 ' HZ2' ' HB3' ' A' ' 66' ' ' LYS . 3.3 mmmp? -52.14 -44.3 64.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.119 -0.492 . . . . 74.239999999999995 112.193 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.15 -24.41 67.15 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.123 0.416 . . . . 75.209999999999994 112.123 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -114.86 10.75 16.5 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.761 0.315 . . . . 75.450000000000003 111.757 176.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m120 62.03 16.06 7.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.992 0.738 . . . . 75.439999999999998 112.992 177.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.422 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 30.4 pt -92.27 165.71 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-O 121.107 0.48 . . . . 74.510000000000005 111.953 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.4 m -89.57 148.4 23.39 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.342 -0.39 . . . . 75.439999999999998 111.338 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.26 134.49 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.099 0.476 . . . . 75.420000000000002 111.745 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.2 p -131.6 155.75 46.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.164 -0.471 . . . . 74.519999999999996 110.066 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.413 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -146.07 128.87 16.29 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.45 0.643 . . . . 74.230000000000004 112.624 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.3 m -100.55 136.13 40.91 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.732 -0.667 . . . . 73.540000000000006 110.615 176.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.2 mm -102.21 135.62 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.644 0.259 . . . . 72.049999999999997 111.307 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.468 ' HD2' HH12 ' A' ' 45' ' ' ARG . 7.9 ptp180 . . . . . 0 N--CA 1.47 0.547 0 CA-C-O 121.304 0.573 . . . . 75.510000000000005 111.555 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttp . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.905 0.383 . . . . 73.530000000000001 111.427 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 35.7 mt-10 -84.86 169.55 14.01 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.646 0.26 . . . . 64.25 110.747 174.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.513 ' HE2' HD11 ' A' ' 5' ' ' ILE . 23.9 ttt -127.41 107.23 9.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.693 0.282 . . . . 74.510000000000005 111.585 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.533 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 5.1 m-20 -93.38 128.28 39.36 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.078 -0.51 . . . . 60.32 111.268 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.513 HD11 ' HE2' ' A' ' 3' ' ' MET . 52.6 mt -136.57 146.29 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.403 0.281 . . . . 73.150000000000006 111.054 179.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.433 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 98.3 mtt180 -131.69 110.4 10.87 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 122.081 -0.387 . . . . 75.540000000000006 111.676 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -89.75 131.93 35.46 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.085 -0.507 . . . . 75.530000000000001 110.999 176.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -135.34 129.13 32.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.351 -0.218 . . . . 75.109999999999999 110.552 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.85 -158.22 9.56 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 120.462 -0.875 . . . . 63.130000000000003 114.394 -176.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.28 13.94 19.21 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.761 0.652 . . . . 53.100000000000001 112.761 -175.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -143.9 150.28 38.17 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.24 0.543 . . . . 72.310000000000002 112.395 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.0 tp -77.02 -57.83 3.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.583 -0.735 . . . . 74.310000000000002 111.579 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.577 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 33.1 mt-10 -62.9 -27.14 69.16 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.122 0.416 . . . . 71.129999999999995 112.122 -176.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.7 68.74 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.874 0.369 . . . . 64.329999999999998 110.942 174.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HB3' HD21 ' A' ' 42' ' ' LEU . 25.1 m-85 -64.02 -41.55 97.41 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.115 0.483 . . . . 72.230000000000004 110.821 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.69 -33.16 74.35 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.81 -0.632 . . . . 70.310000000000002 111.497 -177.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 11.0 mmpt? -64.37 -52.77 56.62 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.214 0.53 . . . . 75.420000000000002 110.246 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.478 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -58.8 -46.73 86.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.832 -0.622 . . . . 73.329999999999998 111.188 177.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -55.52 -47.21 76.61 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.844 -0.616 . . . . 75.239999999999995 111.436 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -60.53 -43.85 96.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.233 -0.439 . . . . 72.420000000000002 111.488 -177.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.56 -42.74 98.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.438 -0.346 . . . . 73.430000000000007 111.659 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.427 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 94.8 mmm -62.32 -44.37 96.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.673 -0.239 . . . . 75.299999999999997 111.364 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.412 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 74.8 mt -64.53 -45.84 94.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 120.784 0.326 . . . . 74.209999999999994 111.089 176.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.9 ttp85 -54.29 -43.97 71.53 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.111 0.481 . . . . 74.120000000000005 111.332 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -74.07 -39.84 63.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.163 -0.472 . . . . 74.430000000000007 111.739 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . 0.444 ' HA ' ' HD2' ' A' ' 29' ' ' PHE . . . -59.76 -29.69 68.34 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.342 0.497 . . . . 70.409999999999997 112.342 -177.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.8 mtp180 -56.81 -28.38 61.4 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.11 0.411 . . . . 74.340000000000003 112.11 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.2 -26.98 67.64 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 111.958 0.355 . . . . 75.120000000000005 111.958 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.444 ' HD2' ' HA ' ' A' ' 26' ' ' ALA . 44.9 m-85 -92.77 142.91 26.82 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 75.040000000000006 111.646 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.67 77.5 6.28 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.159 0.504 . . . . 64.340000000000003 110.941 176.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -154.47 -155.99 7.5 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 120.886 -0.673 . . . . 61.219999999999999 113.934 -177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -128.57 139.72 52.15 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 122.648 -0.325 . . . . 71.430000000000007 111.408 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -114.61 130.29 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.794 0.331 . . . . 75.319999999999993 111.303 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 t -145.29 154.24 42.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.798 0.332 . . . . 63.43 111.679 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -156.38 161.79 40.1 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.108 0.48 . . . . 74.510000000000005 112.162 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.7 t -137.36 141.89 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 110.765 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.9 tp -121.39 128.33 52.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.949 0.404 . . . . 75.530000000000001 111.832 -176.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -127.63 84.67 2.27 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.144 0.497 . . . . 64.120000000000005 110.386 173.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.04 -101.0 0.38 Allowed Glycine 0 CA--C 1.528 0.868 0 CA-C-N 115.66 -0.7 . . . . 64.019999999999996 114.258 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -94.89 11.46 31.64 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.786 0.662 . . . . 73.239999999999995 112.786 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -145.04 133.38 21.75 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.968 0.413 . . . . 72.329999999999998 111.522 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD21 ' HB3' ' A' ' 15' ' ' PHE . 65.5 tp -122.35 117.39 25.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.399 . . . . 74.450000000000003 111.902 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -94.6 118.6 31.95 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.863 0.363 . . . . 71.409999999999997 111.253 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 46.5 mt -118.59 126.68 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.735 0.414 . . . . 75.439999999999998 110.761 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 3' ' ' MET . 39.9 ttp180 -125.15 121.09 33.19 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.952 0.405 . . . . 74.510000000000005 111.566 177.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.43 119.56 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.114 0.483 . . . . 73.510000000000005 110.843 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.475 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 59.2 m -92.35 112.49 24.46 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.946 -0.57 . . . . 74.010000000000005 111.913 -176.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.5 68.96 0.86 Allowed Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.241 -0.504 . . . . 62.210000000000001 113.571 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -126.3 130.32 23.96 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 120.799 0.333 . . . . 72.430000000000007 111.477 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.49 155.41 31.96 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.041 2.494 . . . . 74.010000000000005 114.153 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -66.67 -41.68 87.77 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.823 -0.626 . . . . 71.25 112.437 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.478 ' HG3' HG23 ' A' ' 53' ' ' VAL . 11.4 pt20 -59.23 -26.63 65.04 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.132 0.419 . . . . 70.129999999999995 112.132 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.478 HG23 ' HG3' ' A' ' 52' ' ' GLN . 38.3 t -98.4 -5.38 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-O 120.992 0.425 . . . . 72.430000000000007 111.642 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.506 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 18.1 tpp180 -53.07 -40.7 64.23 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 122.214 -0.303 . . . . 71.120000000000005 111.048 178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -50.93 -50.78 57.03 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.179 0.514 . . . . 73.239999999999995 111.5 177.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -66.73 -54.26 24.7 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.657 -0.701 . . . . 72.430000000000007 111.486 -176.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.97 -46.97 81.82 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.052 -0.522 . . . . 71.519999999999996 111.905 -178.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.93 76.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.876 0.369 . . . . 65.230000000000004 111.606 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -76.19 -36.42 58.65 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.908 0.385 . . . . 73.109999999999999 111.323 -179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -63.65 -45.37 90.5 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.921 0.391 . . . . 73.430000000000007 111.294 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.505 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -60.38 -35.3 75.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.385 -0.37 . . . . 54.329999999999998 111.575 177.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 23.0 mm-40 -55.23 -49.29 72.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.845 0.355 . . . . 63.049999999999997 110.15 172.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 20.9 ttm-85 -56.06 -53.22 59.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.11 -0.495 . . . . 74.120000000000005 110.594 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 61' ' ' ALA . 88.5 mt -48.8 -46.85 42.3 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.714 -0.675 . . . . 74.519999999999996 112.18 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.18 88.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.31 -0.405 . . . . 73.510000000000005 111.781 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 32.2 mmtp -72.36 -35.12 68.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.506 0.558 . . . . 72.430000000000007 112.506 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 13.6 mm-40 -54.27 -41.42 68.83 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.051 0.453 . . . . 74.209999999999994 111.353 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -103.37 1.43 32.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.335 -0.393 . . . . 71.099999999999994 111.498 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.1 m120 54.24 42.32 31.56 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.488 0.661 . . . . 74.540000000000006 111.591 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 35.3 pt -103.74 169.3 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.589 -0.732 . . . . 73.0 111.308 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.6 m -87.71 148.97 24.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.64 0.257 . . . . 72.239999999999995 111.645 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.27 136.17 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.105 0.479 . . . . 73.409999999999997 112.051 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.433 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 73.6 p -118.22 146.47 44.22 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.429 -0.351 . . . . 72.200000000000003 111.179 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -122.93 137.65 54.89 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.117 0.484 . . . . 75.420000000000002 112.225 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 97.6 m -136.34 105.44 5.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.012 -0.54 . . . . 72.349999999999994 109.972 173.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.7 mm -101.29 105.48 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 122.26 -0.275 . . . . 74.510000000000005 110.987 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 18.3 ptp180 . . . . . 0 CA--C 1.544 0.713 0 CA-C-O 121.629 0.728 . . . . 71.040000000000006 111.249 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 47.3 ttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.658 0.266 . . . . 74.25 110.512 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -117.27 155.74 28.96 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.01 0.374 . . . . 72.409999999999997 112.01 -172.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.625 ' HB3' ' NH1' ' A' ' 54' ' ' ARG . 21.8 ptm -149.59 142.36 24.64 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.338 0.495 . . . . 75.040000000000006 112.338 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -112.67 118.36 34.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 122.602 0.361 . . . . 72.25 111.518 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.488 HD12 ' HE3' ' A' ' 3' ' ' MET . 59.1 mt -115.96 114.54 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 120.612 0.244 . . . . 71.010000000000005 110.862 175.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.451 ' HD2' ' N ' ' A' ' 6' ' ' ARG . 3.5 mpt_? -109.02 121.59 45.46 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.938 0.399 . . . . 75.040000000000006 111.809 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 88.4 m-85 -94.34 150.18 20.53 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.258 -0.428 . . . . 73.540000000000006 110.922 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 17.2 tpt180 -142.39 120.42 12.1 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.276 -0.42 . . . . 73.120000000000005 110.878 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.513 ' HA3' HG23 ' A' ' 70' ' ' ILE . . . -178.59 -179.35 48.41 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.978 -0.63 . . . . 71.129999999999995 113.108 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -108.49 -17.47 13.97 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.517 0.562 . . . . 61.329999999999998 112.517 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.38 110.18 7.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.027 0.441 . . . . 71.010000000000005 110.898 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 50.6 tp -62.38 -41.73 98.86 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.232 0.456 . . . . 65.310000000000002 112.232 -175.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -66.37 -35.03 79.31 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.577 0.227 . . . . 74.5 111.51 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.6 70.86 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.464 -0.334 . . . . 73.230000000000004 111.691 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -56.18 -51.77 66.82 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.651 -0.249 . . . . 74.329999999999998 111.403 177.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.26 -45.24 85.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.736 0.303 . . . . 71.450000000000003 111.439 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -57.83 -38.77 76.19 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.805 0.336 . . . . 75.099999999999994 111.804 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.534 ' HA ' HD21 ' A' ' 64' ' ' LEU . . . -73.96 -53.14 10.75 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.407 0.623 . . . . 73.239999999999995 111.234 177.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -60.07 -46.1 90.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.628 -0.715 . . . . 65.140000000000001 112.525 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -58.6 -40.0 81.99 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.776 0.43 . . . . 75.319999999999993 111.646 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -73.58 -38.83 65.04 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.889 0.376 . . . . 75.030000000000001 111.198 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 97.1 mmm -58.27 -46.58 85.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.066 0.46 . . . . 74.25 110.452 174.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 69.0 mt -64.63 -39.36 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.048 -0.524 . . . . 74.530000000000001 111.004 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -53.62 -50.11 66.39 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.855 0.36 . . . . 74.150000000000006 111.044 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -67.1 -48.78 67.12 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.397 -0.365 . . . . 72.400000000000006 111.13 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.84 -34.08 67.42 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.685 0.624 . . . . 71.129999999999995 112.685 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -59.21 -27.74 66.0 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.024 0.379 . . . . 75.409999999999997 112.024 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -76.62 -18.26 58.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.816 0.341 . . . . 74.129999999999995 111.875 178.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -108.33 143.79 36.74 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.079 0.466 . . . . 74.400000000000006 111.679 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.3 89.6 5.52 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.077 0.465 . . . . 75.109999999999999 111.759 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -155.97 -155.53 7.42 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.246 -0.502 . . . . 73.120000000000005 112.975 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.3 m -137.73 131.29 31.1 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.519 -0.401 . . . . 63.119999999999997 111.258 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.417 HG23 HG22 ' A' ' 46' ' ' ILE . 88.8 t -124.81 118.62 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.844 0.355 . . . . 74.340000000000003 111.264 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.436 ' OG1' ' HB3' ' A' ' 45' ' ' ARG . 30.3 p -107.41 129.76 54.89 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.531 -0.304 . . . . 71.219999999999999 111.007 179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 52.7 p90 -133.0 142.74 49.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.349 0.5 . . . . 64.120000000000005 112.349 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 64.8 p -133.21 137.99 46.35 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.124 -0.489 . . . . 73.129999999999995 111.456 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.24 134.46 53.76 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.252 -0.431 . . . . 74.239999999999995 110.935 177.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -149.95 95.93 2.37 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.955 0.407 . . . . 72.129999999999995 111.396 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.66 -82.26 0.05 OUTLIER Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.263 -0.494 . . . . 75.340000000000003 113.532 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.484 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 13.0 m120 -122.47 -3.65 8.85 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 122.489 -0.419 . . . . 75.010000000000005 112.014 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -101.95 134.99 44.29 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.992 0.425 . . . . 71.400000000000006 111.822 -177.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 22.9 tp -128.91 99.96 5.49 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.022 -0.536 . . . . 74.25 110.366 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 46.0 mt-10 -91.92 104.48 16.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 75.409999999999997 111.326 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.6 mt -102.14 128.8 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.223 -0.444 . . . . 74.230000000000004 110.409 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.436 ' HB3' ' OG1' ' A' ' 34' ' ' THR . 51.1 ttt180 -126.16 112.57 15.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.93 0.395 . . . . 72.319999999999993 110.475 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.417 HG22 HG23 ' A' ' 33' ' ' VAL . 52.7 mt -104.85 114.47 44.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-O 121.246 0.546 . . . . 75.239999999999995 111.531 -176.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.6 m -105.14 113.82 27.65 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.848 -0.615 . . . . 64.239999999999995 111.769 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.3 -43.54 1.28 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 120.599 -0.81 . . . . 62.100000000000001 114.515 174.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.564 HG22 HH21 ' A' ' 54' ' ' ARG . 17.6 m -50.7 128.8 26.89 Favored Pre-proline 0 N--CA 1.478 0.969 0 N-CA-C 113.833 1.049 . . . . 74.239999999999995 113.833 -172.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -85.42 -169.26 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.772 2.981 . . . . 75.019999999999996 114.277 -177.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -48.45 -72.02 0.06 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.582 0.956 . . . . 75.239999999999995 113.582 -176.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.467 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 24.2 pt20 -50.11 -34.41 21.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.754 0.65 . . . . 64.349999999999994 112.754 -174.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 t -80.23 -36.02 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 120.989 0.423 . . . . 74.439999999999998 111.447 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.625 ' NH1' ' HB3' ' A' ' 3' ' ' MET . 4.5 tpp180 -53.77 -52.78 59.11 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.85 -0.614 . . . . 74.209999999999994 112.016 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 52' ' ' GLN . 22.2 pttp -61.67 -34.68 76.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.091 -0.504 . . . . 75.549999999999997 111.951 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -71.53 -42.51 67.85 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.66 0.267 . . . . 74.150000000000006 111.617 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.42 HD11 HG13 ' A' ' 49' ' ' VAL . 86.6 mt -64.45 -45.35 87.84 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.945 0.402 . . . . 73.519999999999996 111.183 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.29 96.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.171 0.51 . . . . 71.299999999999997 111.203 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -63.77 -35.43 80.58 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.043 -0.526 . . . . 73.319999999999993 111.593 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -67.12 -42.56 84.3 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.915 0.388 . . . . 71.349999999999994 110.998 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.539 ' HB2' HG21 ' A' ' 72' ' ' VAL . . . -52.17 -40.84 62.02 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.082 -0.508 . . . . 72.239999999999995 112.058 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 35.0 mm-40 -61.74 -50.55 71.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.727 0.298 . . . . 72.150000000000006 111.682 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -55.45 -51.7 66.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.94 0.4 . . . . 74.409999999999997 111.101 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' A' ' 18' ' ' ALA . 83.4 mt -55.39 -41.28 72.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.745 -0.661 . . . . 72.230000000000004 111.465 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.513 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -64.68 -50.96 64.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.178 0.513 . . . . 45.140000000000001 112.256 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 10.5 mmpt? -63.19 -60.54 3.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.096 0.776 . . . . 65.230000000000004 113.096 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -75.44 -15.77 60.4 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.962 0.727 . . . . 72.150000000000006 112.962 -172.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' A' ' 64' ' ' LEU . 84.9 m-85 -100.6 8.57 43.34 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 122.079 -0.388 . . . . 74.0 111.973 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 60.46 35.75 20.28 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.584 0.587 . . . . 75.329999999999998 112.584 173.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.513 HG23 ' HA3' ' A' ' 9' ' ' GLY . 20.6 pt -126.06 149.38 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 121.184 0.516 . . . . 75.340000000000003 111.639 179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.7 m -86.97 139.59 30.44 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.403 -0.362 . . . . 72.219999999999999 110.735 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.539 HG21 ' HB2' ' A' ' 61' ' ' ALA . 14.5 p -126.22 122.1 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.547 0.689 . . . . 73.349999999999994 112.414 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 80.9 p -121.18 121.7 38.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.788 -0.642 . . . . 73.109999999999999 110.449 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -122.05 143.09 49.71 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.869 0.692 . . . . 75.439999999999998 112.869 -175.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 94.4 m -122.54 120.26 33.29 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.567 -0.742 . . . . 75.530000000000001 110.612 178.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -118.79 144.86 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.959 0.409 . . . . 70.299999999999997 111.451 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.443 ' HD3' ' HA ' ' A' ' 77' ' ' ARG . 59.3 mmt-85 . . . . . 0 CA--C 1.534 0.362 0 CA-C-O 121.023 0.44 . . . . 75.329999999999998 111.513 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.627 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 49.4 ttp . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.044 0.45 . . . . 70.109999999999999 111.51 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.637 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 27.3 mt-10 -127.42 170.8 12.15 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.115 -0.493 . . . . 73.099999999999994 110.774 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.658 ' SD ' ' NH2' ' A' ' 54' ' ' ARG . 27.5 ttt -143.69 128.0 17.78 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.649 0.611 . . . . 73.140000000000001 112.649 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 6' ' ' ARG . 4.7 m-20 -82.72 128.86 34.77 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.665 -0.698 . . . . 72.510000000000005 110.222 171.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.7 mt -139.56 109.42 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.77 0.319 . . . . 74.549999999999997 111.146 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.672 ' HG3' ' HA ' ' A' ' 43' ' ' GLU . 2.4 mpt_? -119.45 125.41 48.87 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 122.104 -0.373 . . . . 74.420000000000002 111.975 -179.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -109.11 145.56 35.49 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 116.26 -0.427 . . . . 74.140000000000001 111.498 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -142.5 120.09 11.77 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.316 -0.253 . . . . 74.5 110.316 172.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -148.73 159.68 28.12 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.649 -0.786 . . . . 52.399999999999999 113.693 -176.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.98 -13.02 34.17 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.148 0.425 . . . . 73.530000000000001 112.148 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.27 161.08 25.3 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.039 0.447 . . . . 65.310000000000002 111.933 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.3 tp -85.51 -58.51 2.64 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.948 0.404 . . . . 75.319999999999993 111.674 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 41.4 mt-10 -66.78 -30.25 70.41 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 111.979 0.363 . . . . 62.310000000000002 111.979 -175.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.2 -33.17 51.64 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.997 0.369 . . . . 64.010000000000005 111.997 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.408 ' CE1' HD13 ' A' ' 37' ' ' LEU . 77.4 t80 -59.68 -53.56 56.64 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.109 0.481 . . . . 72.439999999999998 111.213 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -73.78 -36.9 65.11 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.016 -0.538 . . . . 74.400000000000006 111.906 -176.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 75.2 mmtt -59.59 -54.21 49.12 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.948 0.404 . . . . 63.340000000000003 111.306 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.48 -47.76 84.74 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.255 -0.43 . . . . 70.439999999999998 111.724 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.32 -45.44 91.32 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.026 0.441 . . . . 64.340000000000003 111.55 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -64.07 -42.91 96.83 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.303 -0.408 . . . . 73.439999999999998 111.653 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -61.8 -46.51 89.23 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.103 0.408 . . . . 73.530000000000001 112.103 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 78.2 mmm -56.52 -44.8 81.14 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.845 0.355 . . . . 75.540000000000006 111.196 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.9 mt -66.13 -43.43 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 121.054 0.454 . . . . 75.409999999999997 110.936 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -53.02 -54.68 31.77 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.229 0.612 . . . . 73.329999999999998 112.017 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.07 -37.75 84.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.774 0.321 . . . . 73.010000000000005 111.512 176.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.24 -25.24 65.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.222 0.452 . . . . 71.409999999999997 112.222 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 11.8 mmm180 -56.59 -27.79 58.8 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.142 0.423 . . . . 74.319999999999993 112.142 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.436 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -61.96 -25.56 67.68 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 111.788 0.292 . . . . 72.129999999999995 111.788 178.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.434 ' CZ ' HG21 ' A' ' 53' ' ' VAL . 23.4 m-85 -118.06 171.73 7.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.449 0.642 . . . . 74.109999999999999 112.074 -173.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.16 90.52 3.96 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.047 -0.524 . . . . 75.030000000000001 110.574 173.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -152.17 164.7 30.58 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 120.975 -0.631 . . . . 52.0 113.355 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -95.95 123.26 39.47 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.777 0.322 . . . . 73.530000000000001 111.594 -177.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t -115.31 119.35 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 116.255 -0.429 . . . . 71.400000000000006 110.552 175.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -130.87 164.48 25.14 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.701 0.286 . . . . 73.420000000000002 111.426 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.522 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.9 p90 -155.23 146.97 23.25 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.007 0.432 . . . . 73.549999999999997 111.683 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 0.518 HG23 ' HB3' ' A' ' 43' ' ' GLU . 0.7 OUTLIER -137.32 137.38 38.88 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.886 0.374 . . . . 74.140000000000001 111.406 178.395 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.408 HD13 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.4 130.47 34.64 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.914 0.388 . . . . 73.519999999999996 111.568 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.58 106.32 7.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.992 0.425 . . . . 75.150000000000006 110.878 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.47 -97.0 0.22 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 121.229 -0.51 . . . . 54.329999999999998 113.335 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -125.29 11.14 8.08 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.132 0.419 . . . . 73.420000000000002 112.132 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -132.67 158.96 40.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.353 0.597 . . . . 64.150000000000006 112.407 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.522 HD11 ' HB2' ' A' ' 35' ' ' TYR . 64.0 tp -109.08 125.29 51.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.778 -0.647 . . . . 74.329999999999998 111.604 -177.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.672 ' HA ' ' HG3' ' A' ' 6' ' ' ARG . 1.5 tm-20 -101.87 108.37 19.82 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 110.471 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -108.6 139.78 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.08 0.466 . . . . 74.120000000000005 112.245 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -125.28 123.28 39.13 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.072 -0.513 . . . . 74.439999999999998 110.763 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.59 121.83 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.819 0.343 . . . . 73.439999999999998 111.45 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.512 HG23 ' HG2' ' A' ' 2' ' ' GLU . 86.2 m -121.86 126.74 49.41 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.28 -0.418 . . . . 74.549999999999997 111.601 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.15 55.32 0.51 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.238 -0.506 . . . . 73.120000000000005 113.941 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.472 HG22 ' HE2' ' A' ' 1' ' ' MET . 24.7 m -133.58 144.37 51.82 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.356 -0.497 . . . . 74.25 111.783 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.83 162.83 10.53 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.909 2.406 . . . . 72.400000000000006 113.598 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.55 -37.06 84.64 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.361 0.504 . . . . 74.409999999999997 112.361 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -60.3 -18.53 50.07 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.736 0.643 . . . . 74.299999999999997 112.736 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.531 HG12 ' HG ' ' A' ' 57' ' ' LEU . 16.4 t -112.42 -2.68 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.397 0.617 . . . . 62.329999999999998 111.066 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.658 ' NH2' ' SD ' ' A' ' 3' ' ' MET . 5.3 tpm_? -52.59 -58.38 6.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.87 -0.604 . . . . 74.25 112.525 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -66.05 -33.34 75.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.036 -0.529 . . . . 75.530000000000001 111.625 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.85 -50.56 70.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.21 -0.45 . . . . 72.430000000000007 111.235 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.531 ' HG ' HG12 ' A' ' 53' ' ' VAL . 98.7 mt -61.36 -38.48 87.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.931 0.396 . . . . 73.219999999999999 111.206 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HA ' ' HE3' ' A' ' 3' ' ' MET . . . -61.12 -42.26 98.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 111.678 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 62' ' ' GLU . 22.0 ttmm -78.51 -32.73 48.26 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 120.903 0.383 . . . . 53.329999999999998 111.954 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 63' ' ' ARG . 29.1 tt0 -64.16 -32.87 74.61 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.952 -0.467 . . . . 72.109999999999999 110.555 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.4 -38.41 74.25 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.372 -0.377 . . . . 73.150000000000006 110.845 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 43.5 mt-10 -59.64 -43.72 93.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.979 0.419 . . . . 72.129999999999995 110.574 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 33.8 ttm180 -54.95 -54.0 48.38 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.28 -0.418 . . . . 71.140000000000001 111.347 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 18' ' ' ALA . 93.5 mt -56.42 -39.19 72.65 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 75.319999999999993 111.687 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.14 -57.13 4.51 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.069 0.461 . . . . 73.230000000000004 111.938 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.82 -24.86 66.22 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.52 . . . . 74.230000000000004 112.403 -174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -61.18 -47.92 83.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.116 0.484 . . . . 72.450000000000003 110.587 179.211 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -104.27 8.68 36.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.152 -0.476 . . . . 74.239999999999995 111.396 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 60.96 24.92 14.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.494 0.553 . . . . 74.019999999999996 112.494 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.2 pt -87.77 166.43 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.006 0.431 . . . . 75.510000000000005 111.673 -177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.2 m -87.54 142.5 27.8 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.48 -0.327 . . . . 72.299999999999997 111.366 -178.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 14.6 p -143.62 134.97 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.135 0.493 . . . . 62.520000000000003 111.839 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -119.43 123.09 43.22 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.697 -0.483 . . . . 74.540000000000006 109.697 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.431 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 34.0 p90 -128.46 135.32 49.3 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.232 0.539 . . . . 74.230000000000004 111.829 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.401 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 86.6 m -133.39 148.55 51.82 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.888 -0.596 . . . . 64.129999999999995 110.781 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.9 mm -101.99 114.28 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.907 0.384 . . . . 74.400000000000006 111.196 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.637 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 13.7 mtp180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.177 0.436 . . . . 74.109999999999999 112.177 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 tmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.806 -0.442 . . . . 73.129999999999995 109.806 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -102.58 148.72 25.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.926 0.394 . . . . 73.319999999999993 111.469 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.7 ttt -124.36 124.44 42.37 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.146 0.498 . . . . 74.239999999999995 112.123 -176.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -106.12 115.34 30.06 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.967 -0.56 . . . . 64.239999999999995 110.798 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.2 mt -120.72 141.69 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.42 0.288 . . . . 64.450000000000003 111.089 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.472 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 26.4 mtm105 -144.37 122.63 12.26 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.153 0.427 . . . . 70.310000000000002 112.153 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.446 ' O ' ' HA ' ' A' ' 41' ' ' ASP . 95.8 m-85 -103.13 125.43 49.83 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.473 -0.33 . . . . 72.430000000000007 111.628 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.502 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 8.2 tpt180 -104.33 119.33 38.73 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.813 0.34 . . . . 75.239999999999995 110.616 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.43 146.63 9.64 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 121.235 -0.507 . . . . 74.430000000000007 113.029 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -94.28 3.07 55.73 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 122.461 -0.434 . . . . 62.219999999999999 112.111 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.08 134.27 37.75 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.089 0.471 . . . . 71.420000000000002 111.991 177.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -71.3 -52.76 17.07 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.218 -0.446 . . . . 54.450000000000003 111.606 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.29 -31.2 67.26 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.783 0.325 . . . . 65.209999999999994 111.792 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.97 -40.14 69.73 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.518 -0.31 . . . . 73.439999999999998 111.69 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -56.64 -54.26 48.1 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.904 0.383 . . . . 74.140000000000001 111.333 176.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.02 -49.95 70.38 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.355 -0.384 . . . . 71.439999999999998 111.765 -178.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 70.3 mmtt -61.87 -54.57 40.29 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.331 0.493 . . . . 75.530000000000001 112.331 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.494 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -57.71 -48.55 79.24 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.82 0.343 . . . . 64.510000000000005 111.879 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.72 -44.68 92.87 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.856 0.36 . . . . 74.349999999999994 111.333 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -62.49 -46.01 90.39 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.966 0.358 . . . . 71.120000000000005 111.966 -177.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 25.7 mm-40 -64.82 -45.54 85.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.634 0.254 . . . . 75.140000000000001 111.557 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.497 ' HE2' ' HA ' ' A' ' 22' ' ' MET . 1.6 mmt -55.8 -50.64 69.94 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.125 0.488 . . . . 73.120000000000005 111.017 176.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.561 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 64.9 mt -62.18 -42.47 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.269 -0.423 . . . . 73.450000000000003 111.429 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.7 ttm-85 -49.28 -48.12 46.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.108 0.48 . . . . 65.140000000000001 111.474 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -68.43 -46.08 70.84 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.939 -0.573 . . . . 75.420000000000002 111.829 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.37 -22.39 63.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.225 0.824 . . . . 52.32 113.225 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.561 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 37.1 mtp85 -56.68 -28.66 61.21 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 112.777 0.658 . . . . 74.239999999999995 112.777 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.413 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 0.4 OUTLIER -74.78 -20.95 59.58 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.969 0.359 . . . . 71.230000000000004 111.969 179.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -106.73 178.0 4.69 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.393 0.616 . . . . 62.210000000000001 112.181 -173.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -89.94 28.07 1.45 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.953 -0.567 . . . . 62.43 111.269 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.16 128.87 9.63 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 116.074 -0.512 . . . . 74.299999999999997 113.182 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 96.2 m -88.49 117.37 27.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.883 0.373 . . . . 73.430000000000007 111.026 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.492 HG22 HG12 ' A' ' 46' ' ' ILE . 77.1 t -103.41 109.79 28.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 120.996 0.427 . . . . 72.420000000000002 111.225 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.4 t -110.86 157.06 20.26 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.361 -0.381 . . . . 74.239999999999995 110.894 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.425 ' HB2' HD11 ' A' ' 42' ' ' LEU . 29.3 p90 -140.96 133.87 29.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.128 0.489 . . . . 75.120000000000005 112.1 -176.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 p -129.61 130.54 45.78 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.078 -0.51 . . . . 72.420000000000002 110.528 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -91.36 120.35 32.15 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.946 0.35 . . . . 64.329999999999998 111.946 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -113.25 88.97 2.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.941 0.4 . . . . 71.430000000000007 109.973 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.68 -101.2 0.23 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.167 -0.54 . . . . 72.439999999999998 113.558 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -109.03 13.21 24.76 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.584 -0.363 . . . . 70.420000000000002 111.669 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.446 ' HA ' ' O ' ' A' ' 7' ' ' PHE . 21.8 t70 -119.47 121.85 40.38 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.134 0.492 . . . . 74.420000000000002 110.654 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.425 HD11 ' HB2' ' A' ' 35' ' ' TYR . 41.5 tp -94.47 106.84 18.83 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.194 -0.457 . . . . 75.040000000000006 110.897 178.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.472 ' HG2' ' HG2' ' A' ' 6' ' ' ARG . 36.2 mt-10 -85.06 103.85 14.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.97 0.414 . . . . 70.299999999999997 111.068 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 113.2 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 120.984 0.421 . . . . 75.239999999999995 111.066 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -109.06 120.82 43.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.813 0.339 . . . . 72.140000000000001 111.154 -178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.492 HG12 HG22 ' A' ' 33' ' ' VAL . 53.4 mt -110.99 112.39 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 120.942 0.401 . . . . 74.430000000000007 111.214 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 73.0 m -107.01 132.49 52.88 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.186 0.439 . . . . 71.230000000000004 112.186 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.86 62.02 1.88 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.409 -0.424 . . . . 74.5 114.152 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 m -133.01 139.03 33.16 Favored Pre-proline 0 CA--C 1.545 0.773 0 O-C-N 122.481 -0.423 . . . . 75.040000000000006 111.944 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -58.05 132.61 50.44 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.738 2.292 . . . . 74.329999999999998 113.081 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -52.11 -36.4 50.94 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.076 0.769 . . . . 62.109999999999999 113.076 -174.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -67.2 -34.76 78.19 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 120.803 0.335 . . . . 73.450000000000003 111.871 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.2 t -75.21 -19.19 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 121.105 0.478 . . . . 74.040000000000006 111.185 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -50.6 -36.47 35.13 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.044 -0.526 . . . . 74.439999999999998 111.971 177.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -61.91 -43.08 99.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.702 -0.226 . . . . 73.329999999999998 111.496 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -64.61 -43.35 94.05 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.802 0.334 . . . . 72.340000000000003 111.121 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.8 -42.61 99.23 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.02 0.438 . . . . 74.420000000000002 111.05 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -67.87 -45.33 74.82 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 65.319999999999993 111.591 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -65.95 -32.82 74.53 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 75.129999999999995 111.427 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.59 -45.46 93.88 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.641 -0.503 . . . . 74.129999999999995 109.641 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.75 97.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.137 -0.483 . . . . 52.240000000000002 111.541 176.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-10 -55.54 -45.51 77.19 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.279 0.561 . . . . 74.010000000000005 110.533 175.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.98 -49.51 69.99 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.584 -0.735 . . . . 74.209999999999994 111.412 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 18' ' ' ALA . 91.8 mt -54.43 -45.2 72.97 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.029 0.381 . . . . 73.519999999999996 112.029 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.27 -56.72 15.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.807 0.337 . . . . 74.519999999999996 111.724 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -61.85 -35.75 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.147 0.425 . . . . 75.319999999999993 112.147 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.74 -34.94 73.61 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.03 0.443 . . . . 72.040000000000006 111.243 -178.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -105.71 0.04 25.9 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.349 -0.387 . . . . 72.310000000000002 111.553 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 61.17 21.62 12.04 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.113 0.565 . . . . 71.430000000000007 112.078 -177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.439 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 33.2 pt -86.92 175.34 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.015 0.436 . . . . 75.099999999999994 111.239 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 22.8 m -93.54 146.42 23.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.738 0.304 . . . . 73.109999999999999 111.318 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.2 p -137.6 139.57 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.148 0.499 . . . . 75.109999999999999 111.518 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.9 p -132.49 143.13 49.55 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.086 -0.507 . . . . 72.319999999999993 110.097 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -147.57 134.13 19.82 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.213 0.53 . . . . 74.120000000000005 111.916 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.3 p -121.08 145.0 48.25 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.957 -0.565 . . . . 71.340000000000003 110.822 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.7 mm -117.26 144.78 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.626 -0.261 . . . . 75.540000000000006 110.945 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 . . . . . 0 N--CA 1.467 0.376 0 CA-C-O 121.234 0.54 . . . . 73.219999999999999 111.66 175.458 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.632 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.0 mtp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.14 0.495 . . . . 74.530000000000001 111.558 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -133.43 147.4 51.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.005 -0.543 . . . . 74.450000000000003 109.586 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.457 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 28.6 ttt -148.88 118.99 7.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.092 0.775 . . . . 72.400000000000006 113.092 -173.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.401 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 6.5 m-20 -87.97 119.39 28.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.445 -0.343 . . . . 64.510000000000005 110.38 172.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.449 HG12 ' HE3' ' A' ' 3' ' ' MET . 51.2 mt -116.33 108.4 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.032 0.444 . . . . 74.340000000000003 111.064 178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.42 ' HG2' ' HB2' ' A' ' 43' ' ' GLU . 61.8 mtm-85 -98.56 102.1 13.74 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.575 0.583 . . . . 74.200000000000003 112.575 -176.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -85.78 143.24 28.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.454 -0.339 . . . . 73.230000000000004 110.305 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.56 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 43.9 ttt180 -141.47 118.88 11.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.564 0.221 . . . . 73.329999999999998 110.599 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.96 153.19 24.65 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.194 -0.527 . . . . 63.109999999999999 113.136 -176.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -97.49 -14.27 21.22 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.045 0.757 . . . . 64.230000000000004 113.045 -174.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.464 ' CG ' ' H ' ' A' ' 12' ' ' LEU . 7.2 p-10 -72.66 -91.13 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 112.87 0.693 . . . . 75.310000000000002 112.87 -174.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.464 ' H ' ' CG ' ' A' ' 11' ' ' ASP . 57.9 tp 171.14 -51.82 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.145 0.578 . . . . 74.549999999999997 110.04 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.546 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 48.7 mt-10 -62.39 -29.93 70.84 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.652 -0.704 . . . . 54.039999999999999 111.687 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.71 -39.67 62.27 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.817 0.342 . . . . 75.319999999999993 111.383 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -62.47 -60.53 3.42 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.928 0.394 . . . . 75.010000000000005 111.574 176.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -63.12 -50.51 70.2 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.499 0.555 . . . . 74.400000000000006 112.499 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 65.0 mmtt -67.02 -46.1 75.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 111.742 0.275 . . . . 74.310000000000002 111.742 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.421 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -63.96 -46.21 85.7 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.781 0.324 . . . . 74.120000000000005 111.369 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.03 -47.23 78.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.017 0.437 . . . . 73.540000000000006 110.566 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -52.07 -55.92 17.66 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.704 -0.68 . . . . 74.129999999999995 112.166 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.89 -42.5 97.44 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.157 0.429 . . . . 73.209999999999994 112.157 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 77.6 mmm -61.94 -45.16 94.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.636 0.255 . . . . 74.420000000000002 111.294 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.444 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 66.7 mt -60.36 -40.45 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.733 0.302 . . . . 75.299999999999997 110.634 175.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -56.6 -41.98 77.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.866 0.365 . . . . 73.420000000000002 111.041 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -69.28 -42.87 74.94 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.059 0.457 . . . . 72.450000000000003 111.183 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.82 -35.52 81.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.377 -0.374 . . . . 72.129999999999995 111.816 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 41.4 mtp85 -64.36 -28.88 70.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.189 0.44 . . . . 73.450000000000003 112.189 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -55.32 -43.39 74.87 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.285 0.564 . . . . 73.430000000000007 110.491 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -97.84 -6.15 33.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.773 -0.649 . . . . 74.219999999999999 111.838 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 60.17 42.83 14.84 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.053 0.454 . . . . 64.140000000000001 111.922 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -87.57 -175.96 48.45 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.268 -0.491 . . . . 72.340000000000003 113.784 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.6 m -94.76 131.45 40.58 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.649 0.38 . . . . 74.310000000000002 111.315 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.34 125.56 70.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 112.165 0.431 . . . . 62.310000000000002 112.165 -178.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -136.26 144.83 45.01 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.217 -0.447 . . . . 72.120000000000005 110.773 173.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 44.3 p90 -142.84 140.68 31.38 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.566 0.58 . . . . 73.109999999999999 112.566 -176.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 p -115.24 141.83 47.49 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 116.01 -0.541 . . . . 74.109999999999999 111.696 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -113.36 125.73 54.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.031 0.443 . . . . 74.430000000000007 112.067 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.47 96.35 2.97 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.29 -0.414 . . . . 73.209999999999994 110.346 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.89 -101.12 0.62 Allowed Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.993 -0.622 . . . . 61.219999999999999 112.862 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -110.04 3.93 20.81 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.973 0.416 . . . . 74.209999999999994 110.992 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -93.8 130.74 39.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.097 -0.502 . . . . 73.109999999999999 112.044 -175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.1 tp -131.68 101.55 5.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.097 -0.502 . . . . 74.510000000000005 110.955 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.5 tt0 -97.27 108.77 21.57 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.884 0.374 . . . . 75.010000000000005 111.116 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.8 mt -101.95 108.57 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.226 -0.443 . . . . 73.349999999999994 110.867 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -93.11 111.3 22.89 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.878 0.371 . . . . 72.099999999999994 110.684 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.7 mt -101.98 110.41 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.312 0.577 . . . . 65.239999999999995 110.734 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -97.84 130.44 44.75 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 73.049999999999997 111.154 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.05 -15.88 15.82 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 120.95 -0.643 . . . . 62.130000000000003 113.558 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.894 HG22 HH22 ' A' ' 54' ' ' ARG . 15.1 m -61.2 138.64 94.5 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-N 117.221 0.511 . . . . 73.109999999999999 112.086 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.62 -176.87 3.2 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.191 2.594 . . . . 75.25 114.286 -173.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 10.2 pt-20 -90.49 -50.48 5.92 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.581 0.585 . . . . 64.299999999999997 112.581 -176.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -64.11 -40.5 96.33 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.649 0.611 . . . . 70.439999999999998 112.649 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 53' ' ' VAL . 22.8 t -73.58 -3.33 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 CA-C-O 120.955 0.407 . . . . 75.299999999999997 111.847 -177.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.894 HH22 HG22 ' A' ' 49' ' ' VAL . 18.4 tpp180 -51.22 -35.39 36.53 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.127 0.417 . . . . 72.319999999999993 112.127 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -55.76 -53.59 54.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.255 0.55 . . . . 75.420000000000002 111.378 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -74.54 -32.86 62.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.158 -0.474 . . . . 72.319999999999993 111.864 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.3 mt -56.75 -43.66 80.97 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.114 0.483 . . . . 74.340000000000003 111.065 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.07 73.29 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.026 0.441 . . . . 74.420000000000002 111.109 175.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -56.52 -39.61 73.64 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.961 -0.563 . . . . 75.329999999999998 111.94 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -64.81 -48.22 75.19 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.908 0.385 . . . . 44.32 110.904 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.28 -43.9 88.21 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.155 -0.475 . . . . 61.25 111.264 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 49.5 mt-10 -60.96 -42.14 97.72 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.309 -0.405 . . . . 72.409999999999997 111.168 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.571 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 27.9 ttm180 -55.26 -54.9 37.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.69 0.281 . . . . 75.439999999999998 110.653 174.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.5 mt -52.63 -45.9 66.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.17 -0.468 . . . . 72.299999999999997 111.675 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.67 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.402 -0.363 . . . . 72.5 111.85 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 34.0 mmtp -72.3 -30.23 64.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.178 0.436 . . . . 65.150000000000006 112.178 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.7 mm-40 -61.9 -38.51 88.62 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 122.118 -0.364 . . . . 73.430000000000007 111.598 178.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -100.87 -5.89 25.48 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.862 0.319 . . . . 70.150000000000006 111.862 178.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 56.64 60.03 3.28 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.643 0.735 . . . . 75.400000000000006 110.551 -173.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 39.6 pt -125.39 -176.37 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 115.502 -0.772 . . . . 73.230000000000004 111.28 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.5 m -98.89 141.42 31.69 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.596 -0.275 . . . . 61.299999999999997 111.712 -177.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.1 p -142.03 129.26 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.449 0.642 . . . . 74.409999999999997 111.792 176.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -129.87 123.29 30.47 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 116.12 -0.491 . . . . 74.319999999999993 110.273 175.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.401 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.7 p90 -125.57 136.63 53.5 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.523 0.677 . . . . 75.5 112.734 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 64.9 m -103.56 123.16 46.43 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.512 -0.767 . . . . 64.049999999999997 110.936 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.625 HD11 ' HD2' ' A' ' 54' ' ' ARG . 42.4 mm -94.22 114.13 30.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.68 0.276 . . . . 75.230000000000004 111.67 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 120.952 0.406 . . . . 74.099999999999994 111.317 177.387 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.536 ' HE3' ' HB2' ' A' ' 54' ' ' ARG . 6.3 tmm? . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 110.062 -0.347 . . . . 74.329999999999998 110.062 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.528 ' N ' ' SD ' ' A' ' 1' ' ' MET . 26.5 mt-10 -132.62 137.71 47.13 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.072 0.463 . . . . 72.430000000000007 111.788 -175.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.559 ' HE2' HD12 ' A' ' 5' ' ' ILE . 26.3 ttt -139.33 106.91 5.58 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.943 -0.571 . . . . 74.409999999999997 111.247 -170.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 16.0 m-20 -90.89 106.93 18.86 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.476 0.311 . . . . 63.32 111.39 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.559 HD12 ' HE2' ' A' ' 3' ' ' MET . 36.9 mm -97.51 109.3 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.706 0.289 . . . . 75.340000000000003 111.208 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 2.5 ttp180 -118.67 116.35 26.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.325 0.583 . . . . 74.540000000000006 112.097 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -95.15 142.57 27.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.839 -0.618 . . . . 74.510000000000005 111.379 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -141.91 121.11 13.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 111.222 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.61 -165.22 36.47 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.964 -0.636 . . . . 36.170000000000002 113.311 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -123.66 102.13 7.67 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 122.48 -0.424 . . . . 71.239999999999995 111.867 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 14' ' ' ALA . 19.3 t70 -176.82 141.86 0.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.051 -0.522 . . . . 75.340000000000003 110.416 175.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.1 tp -76.01 -44.48 39.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 111.97 0.359 . . . . 74.450000000000003 111.97 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 4.8 mp0 -73.97 -27.52 61.03 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 112.1 0.407 . . . . 53.43 112.1 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.431 ' HB2' ' HB3' ' A' ' 11' ' ' ASP . . . -52.99 -47.59 68.12 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.193 0.812 . . . . 74.519999999999996 113.193 -173.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -60.95 -61.27 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.22 0.452 . . . . 65.439999999999998 112.22 -176.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.46 -39.38 91.93 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.597 0.591 . . . . 73.400000000000006 112.597 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 10.5 mmmt -65.83 -52.93 46.41 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.27 0.47 . . . . 71.519999999999996 112.27 -179.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.8 88.19 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.294 0.568 . . . . 64.340000000000003 110.791 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 tp -63.26 -41.44 99.05 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.682 -0.69 . . . . 73.329999999999998 111.43 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -57.22 -48.46 78.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.157 -0.474 . . . . 75.049999999999997 111.935 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -60.61 -44.87 95.81 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.09 0.472 . . . . 74.319999999999993 111.384 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 96.3 mmm -61.53 -49.08 78.15 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.192 -0.458 . . . . 73.420000000000002 111.525 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.82 -37.68 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 120.741 0.305 . . . . 73.349999999999994 111.366 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -53.67 -47.9 69.96 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.892 0.377 . . . . 75.540000000000006 111.119 177.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 72.2 mm-40 -74.35 -40.16 62.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.322 -0.399 . . . . 64.239999999999995 111.276 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.13 -38.58 79.97 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.308 0.484 . . . . 64.140000000000001 112.308 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -59.92 -29.55 68.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.061 0.458 . . . . 73.019999999999996 111.466 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.627 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 50.7 mtpt -72.22 -13.81 61.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 111.759 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -110.46 -177.26 3.19 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.013 0.435 . . . . 74.209999999999994 111.167 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -96.93 -10.72 25.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.765 0.317 . . . . 63.310000000000002 111.746 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.34 150.61 51.95 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.488 -0.387 . . . . 74.109999999999999 113.76 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 144.52 27.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.028 0.442 . . . . 64.129999999999995 111.518 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG21 HG22 ' A' ' 46' ' ' ILE . 84.5 t -129.36 131.61 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.161 -0.472 . . . . 53.530000000000001 111.045 178.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -131.8 140.25 49.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.733 0.302 . . . . 71.310000000000002 110.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -131.8 151.48 51.64 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.291 0.478 . . . . 75.0 112.291 -174.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 t -137.26 131.68 32.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.062 -0.517 . . . . 72.010000000000005 111.33 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.404 HD12 HD12 ' A' ' 42' ' ' LEU . 4.0 mm? -100.91 123.61 45.36 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.947 0.403 . . . . 75.340000000000003 111.271 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -121.7 83.86 2.16 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.26 0.552 . . . . 71.319999999999993 110.209 174.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.23 -101.2 0.3 Allowed Glycine 0 CA--C 1.528 0.857 0 CA-C-N 115.752 -0.658 . . . . 62.409999999999997 113.159 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -108.58 21.77 16.84 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.059 0.457 . . . . 55.109999999999999 111.437 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -127.94 140.5 51.96 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 116.087 -0.506 . . . . 73.109999999999999 110.377 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 31.7 tp -134.17 118.81 18.07 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.104 0.409 . . . . 74.329999999999998 112.104 -177.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -108.83 131.77 54.66 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.641 0.257 . . . . 72.200000000000003 110.743 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -127.11 109.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 120.88 0.372 . . . . 74.329999999999998 110.981 -179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 45' ' ' ARG . 15.2 ttp85 -92.48 108.54 20.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.002 0.429 . . . . 73.209999999999994 111.402 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.443 HG22 HG21 ' A' ' 33' ' ' VAL . 58.2 mt -102.74 136.63 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 116.11 -0.496 . . . . 61.509999999999998 111.369 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.8 m -144.04 121.77 11.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 122.24 -0.288 . . . . 73.340000000000003 111.386 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 133.04 -27.8 3.41 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 120.87 -0.681 . . . . 62.450000000000003 114.275 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.3 m -71.24 134.64 84.91 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 122.238 -0.566 . . . . 72.239999999999995 111.7 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.97 153.91 74.08 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.719 2.279 . . . . 64.209999999999994 113.512 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -31.24 64.34 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.555 0.946 . . . . 62.409999999999997 113.555 -175.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -71.83 -33.88 68.84 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.411 0.523 . . . . 72.010000000000005 112.411 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -81.41 -30.12 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 121.186 0.517 . . . . 73.109999999999999 110.677 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.536 ' HB2' ' HE3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -49.09 -45.75 43.69 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.591 -0.731 . . . . 73.340000000000003 112.194 177.357 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -65.18 -31.03 72.0 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.865 0.364 . . . . 64.230000000000004 111.712 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -71.51 -44.67 64.24 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.091 0.472 . . . . 74.349999999999994 110.233 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.34 -35.78 81.52 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.045 -0.525 . . . . 72.450000000000003 111.15 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.38 -45.05 95.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.996 0.427 . . . . 74.310000000000002 111.247 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.2 -43.71 87.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.168 -0.469 . . . . 73.230000000000004 110.85 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.65 -42.23 86.97 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.132 -0.486 . . . . 74.5 111.191 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.79 -45.42 78.22 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.993 0.425 . . . . 71.200000000000003 111.418 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -64.99 -36.47 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.987 0.422 . . . . 72.239999999999995 111.034 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 9.9 tpp180 -59.49 -48.04 83.18 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.249 -0.432 . . . . 74.099999999999994 110.26 175.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.29 -43.6 74.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.695 -0.684 . . . . 75.019999999999996 111.627 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.56 75.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.185 0.517 . . . . 64.219999999999999 111.278 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.32 -38.01 86.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.966 -0.561 . . . . 73.299999999999997 111.409 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 8.1 mm-40 -53.27 -35.4 60.01 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.409 -0.36 . . . . 75.239999999999995 111.834 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -114.74 6.19 15.51 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.315 0.487 . . . . 73.329999999999998 112.315 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.529 ' N ' HD21 ' A' ' 69' ' ' ASN . 0.8 OUTLIER 60.83 24.97 14.89 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.844 0.354 . . . . 74.150000000000006 111.834 179.499 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -101.49 -179.51 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.902 0.382 . . . . 75.420000000000002 111.506 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 95.6 m -102.67 131.75 49.25 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.8 0.333 . . . . 74.409999999999997 111.778 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -111.09 134.2 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.261 0.553 . . . . 74.540000000000006 111.228 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.9 p -130.84 121.1 24.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.951 -0.568 . . . . 73.239999999999995 110.224 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 17.0 p90 -129.5 129.35 44.44 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.366 0.603 . . . . 64.439999999999998 112.51 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.9 m -103.73 119.17 38.36 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.561 -0.745 . . . . 73.099999999999994 110.518 178.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.536 HG12 ' HG3' ' A' ' 3' ' ' MET . 24.2 mt -122.95 133.83 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 122.063 -0.398 . . . . 73.420000000000002 112.029 -175.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 121.122 0.487 . . . . 73.140000000000001 111.155 175.632 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.773 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 35.5 ttm . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.705 0.288 . . . . 75.420000000000002 111.022 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.403 ' CD ' HH21 ' A' ' 77' ' ' ARG . 37.6 tt0 -127.2 132.63 50.42 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.683 0.278 . . . . 65.420000000000002 110.631 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.54 ' HG3' HG12 ' A' ' 76' ' ' ILE . 25.9 ttt -130.14 118.09 20.94 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 120.826 0.346 . . . . 73.219999999999999 111.576 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.52 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 13.4 t70 -97.49 114.66 26.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.832 0.453 . . . . 51.299999999999997 110.796 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.437 HD12 ' HE3' ' A' ' 22' ' ' MET . 62.2 mt -121.84 113.54 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 122.372 0.269 . . . . 70.25 111.462 -177.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.515 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 6.0 ptm180 -106.93 138.06 43.82 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.136 0.493 . . . . 73.310000000000002 112.16 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.93 142.19 44.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.031 -0.531 . . . . 73.239999999999995 110.996 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 26.4 ttt85 -142.46 132.43 24.41 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.591 -0.277 . . . . 74.340000000000003 110.722 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.439 ' HA3' HG23 ' A' ' 70' ' ' ILE . . . -179.37 -165.48 33.61 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 120.441 -0.885 . . . . 75.310000000000002 113.949 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.23 -19.91 12.07 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 122.697 0.399 . . . . 74.120000000000005 111.885 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.3 118.2 8.31 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.18 0.514 . . . . 75.219999999999999 112.353 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.06 -61.01 2.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.978 -0.555 . . . . 65.109999999999999 112.352 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 43.5 tt0 -60.48 -26.64 66.96 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.057 0.391 . . . . 70.049999999999997 112.057 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.41 -28.79 31.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.676 0.274 . . . . 50.399999999999999 111.351 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.68 -60.36 3.67 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.336 -0.393 . . . . 73.5 111.337 174.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -71.01 -28.57 64.5 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.514 -0.312 . . . . 74.049999999999997 111.649 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.544 ' HG2' ' HG2' ' A' ' 13' ' ' GLU . 31.8 mmmt -67.76 -54.91 15.46 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.863 0.363 . . . . 74.230000000000004 111.082 177.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -64.84 -51.59 61.24 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.261 -0.427 . . . . 73.150000000000006 111.437 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.97 -48.35 70.42 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.901 0.381 . . . . 74.510000000000005 111.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -60.85 -45.98 92.37 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.351 -0.386 . . . . 63.549999999999997 111.816 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 25' ' ' GLN . 17.3 mm-40 -64.15 -44.92 90.63 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.871 0.322 . . . . 72.340000000000003 111.871 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 96.6 mmm -56.56 -53.09 61.56 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.997 0.427 . . . . 74.299999999999997 111.335 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.528 ' HA ' HG22 ' A' ' 33' ' ' VAL . 60.9 mt -61.39 -41.07 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.243 0.544 . . . . 74.120000000000005 110.809 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.46 -36.6 64.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.594 -0.73 . . . . 75.209999999999994 111.995 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 21' ' ' GLU . 29.7 mm-40 -74.26 -54.18 8.24 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.997 0.427 . . . . 75.129999999999995 111.663 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.2 75.44 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.737 1.014 . . . . 73.140000000000001 113.737 -171.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -56.95 -27.81 61.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.232 0.827 . . . . 74.219999999999999 113.232 -174.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.06 -25.91 66.49 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.724 0.297 . . . . 73.319999999999993 111.688 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -107.88 -175.37 2.76 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.021 0.439 . . . . 73.439999999999998 111.802 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.38 33.5 0.35 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.005 0.431 . . . . 72.049999999999997 111.941 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.73 161.83 12.89 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.264 -0.493 . . . . 73.409999999999997 113.819 -175.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.7 m -132.22 135.96 46.67 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.463 0.305 . . . . 62.049999999999997 110.71 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 23' ' ' ILE . 95.0 t -98.25 113.86 34.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.044 0.45 . . . . 72.319999999999993 112.15 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 t -107.91 141.51 39.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 110.225 173.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.453 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 40.1 p90 -150.53 152.01 33.52 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.984 0.421 . . . . 74.230000000000004 112.094 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.3 t -132.36 138.58 47.79 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.078 -0.51 . . . . 75.540000000000006 111.5 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.18 140.35 37.47 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.918 0.389 . . . . 73.430000000000007 112.037 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.32 99.97 2.4 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 110.93 171.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.94 -95.13 0.06 OUTLIER Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.272 -0.49 . . . . 51.549999999999997 113.392 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.428 HD21 ' HG3' ' A' ' 8' ' ' ARG . 3.1 p-10 -111.31 4.65 19.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.062 0.393 . . . . 74.230000000000004 112.062 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -108.47 137.68 46.03 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.321 0.582 . . . . 73.219999999999999 112.477 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 tp -134.3 99.46 4.39 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.36 -0.836 . . . . 73.329999999999998 110.452 176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 31.7 mt-10 -93.0 115.97 28.62 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.162 -0.337 . . . . 73.400000000000006 111.217 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 74.1 mt -114.11 109.93 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 116.243 -0.435 . . . . 75.439999999999998 111.907 -176.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -106.53 132.13 52.89 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.002 -0.436 . . . . 73.239999999999995 111.354 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.516 HG12 HG21 ' A' ' 33' ' ' VAL . 45.8 mt -107.63 114.35 46.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.082 0.468 . . . . 74.140000000000001 110.805 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.7 m -101.61 122.35 43.7 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.272 -0.422 . . . . 74.219999999999999 111.846 -178.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.85 49.6 1.15 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.251 -0.5 . . . . 61.340000000000003 114.335 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.3 m -122.81 144.91 43.96 Favored Pre-proline 0 N--CA 1.472 0.65 0 O-C-N 122.233 -0.569 . . . . 71.519999999999996 112.269 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.39 160.06 39.28 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.03 2.487 . . . . 74.230000000000004 112.109 172.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -62.39 -36.94 83.89 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.994 -0.441 . . . . 72.409999999999997 111.955 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -61.11 -19.99 62.12 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.122 0.487 . . . . 75.310000000000002 111.183 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.75 -36.5 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 116.063 -0.517 . . . . 62.210000000000001 110.889 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.773 ' HD2' ' SD ' ' A' ' 1' ' ' MET . 31.4 ttt180 -45.55 -53.08 9.52 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.242 0.544 . . . . 71.430000000000007 111.528 173.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -58.77 -34.12 71.07 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.915 -0.584 . . . . 74.040000000000006 111.674 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -75.54 -35.26 60.72 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.285 -0.416 . . . . 72.129999999999995 111.428 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.84 -45.04 94.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.076 0.465 . . . . 74.510000000000005 110.849 176.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 62' ' ' GLU . . . -60.76 -50.42 73.55 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.149 -0.478 . . . . 71.040000000000006 111.159 175.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -55.17 -36.8 66.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.156 -0.475 . . . . 71.409999999999997 112.21 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -75.12 -43.89 50.2 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.975 0.417 . . . . 71.010000000000005 111.112 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.06 -38.05 78.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.755 0.312 . . . . 61.229999999999997 111.78 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 7.1 mm-40 -53.38 -46.34 69.61 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.971 0.415 . . . . 74.299999999999997 111.047 175.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ttm-85 -61.67 -50.93 70.52 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.965 0.412 . . . . 75.349999999999994 110.694 178.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.83 -43.88 66.32 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.908 -0.587 . . . . 73.430000000000007 111.778 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . 0.452 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -66.18 -57.32 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.012 0.434 . . . . 71.329999999999998 111.981 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -62.67 -43.07 99.75 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.43 0.53 . . . . 75.209999999999994 112.43 -175.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.43 -36.86 83.71 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.804 -174.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.33 7.69 31.38 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.844 0.313 . . . . 72.099999999999994 111.844 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 58.38 27.69 15.74 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.028 0.442 . . . . 65.109999999999999 112.01 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 65' ' ' ALA . 24.5 pt -96.25 154.84 3.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 121.056 0.455 . . . . 73.329999999999998 111.062 178.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.523 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 45.8 p -88.31 143.14 27.2 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.959 0.409 . . . . 72.439999999999998 111.88 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 12.1 p -141.88 135.6 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.18 0.514 . . . . 75.25 112.172 -177.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.7 p -128.75 143.22 50.87 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.371 -0.377 . . . . 72.340000000000003 110.014 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 21.0 p90 -131.35 115.33 16.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.394 0.616 . . . . 73.450000000000003 112.279 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 96.6 m -104.19 124.93 50.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.729 -0.669 . . . . 74.219999999999999 110.418 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.54 HG12 ' HG3' ' A' ' 3' ' ' MET . 44.3 mt -118.64 139.81 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.131 0.491 . . . . 73.530000000000001 112.237 -174.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.403 HH21 ' CD ' ' A' ' 2' ' ' GLU . 18.8 ptt180 . . . . . 0 CA--C 1.539 0.546 0 CA-C-N 116.117 -0.492 . . . . 62.549999999999997 110.636 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.696 ' SD ' ' HD3' ' A' ' 54' ' ' ARG . 47.5 ttp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.715 0.293 . . . . 75.540000000000006 111.144 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . 0.507 ' CD ' HH21 ' A' ' 45' ' ' ARG . 40.4 mt-10 -132.31 142.41 49.35 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.966 0.412 . . . . 75.519999999999996 111.36 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.505 ' HE2' HD12 ' A' ' 5' ' ' ILE . 21.1 ptm -133.06 118.63 18.99 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.289 0.566 . . . . 75.430000000000007 111.294 178.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -100.73 114.43 28.19 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.744 -0.662 . . . . 72.099999999999994 110.814 -178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.505 HD12 ' HE2' ' A' ' 3' ' ' MET . 45.1 mt -106.39 120.42 57.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.264 0.554 . . . . 74.409999999999997 111.365 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -103.7 105.32 15.51 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.067 -0.515 . . . . 73.120000000000005 111.747 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -93.56 146.98 23.4 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.156 0.503 . . . . 74.230000000000004 111.974 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -143.03 120.78 11.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.304 -0.407 . . . . 71.150000000000006 110.674 171.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.65 156.52 28.23 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.776 -0.726 . . . . 63.520000000000003 112.94 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -89.1 -30.15 18.86 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.807 0.336 . . . . 74.230000000000004 111.412 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.9 120.53 13.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.948 0.404 . . . . 65.230000000000004 111.793 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 48.1 tp -63.75 -41.27 98.04 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.993 0.425 . . . . 73.219999999999999 111.316 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.09 -36.8 71.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.088 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -40.56 83.53 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.332 -0.395 . . . . 75.409999999999997 111.423 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.427 ' HE1' HD23 ' A' ' 37' ' ' LEU . 15.3 t80 -53.72 -58.68 6.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.193 -0.458 . . . . 72.340000000000003 111.74 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.69 -40.58 72.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.001 0.371 . . . . 72.219999999999999 112.001 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HD3' ' HA ' ' A' ' 17' ' ' LYS . 67.9 mmtt -62.98 -46.7 86.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.393 0.516 . . . . 74.409999999999997 112.393 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.542 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.83 -49.05 79.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.902 0.382 . . . . 61.310000000000002 111.104 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -61.24 -41.02 96.17 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.128 0.489 . . . . 65.310000000000002 111.177 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -58.99 -54.86 42.42 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.768 -0.651 . . . . 74.329999999999998 111.802 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.99 -42.47 97.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.209 0.448 . . . . 73.120000000000005 112.209 -176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.542 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 85.3 mmm -57.66 -48.57 79.13 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.119 -0.363 . . . . 73.299999999999997 111.148 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.499 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 63.0 mt -66.47 -38.44 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.212 0.53 . . . . 74.510000000000005 110.863 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.633 -0.712 . . . . 71.549999999999997 111.624 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -73.89 -40.92 62.83 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.641 0.258 . . . . 73.439999999999998 111.58 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.13 -29.97 64.03 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.856 0.687 . . . . 74.420000000000002 112.856 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.5 mtp180 -56.77 -29.57 62.77 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.378 0.51 . . . . 74.239999999999995 112.378 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.689 ' HZ3' ' HB3' ' A' ' 28' ' ' LYS . 3.5 mmmp? -75.26 -13.27 60.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.038 0.447 . . . . 72.239999999999995 111.715 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -120.54 178.73 4.56 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.07 0.462 . . . . 74.530000000000001 111.281 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.99 38.0 0.33 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.193 0.52 . . . . 72.239999999999995 111.505 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.35 124.64 7.68 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 114.345 0.498 . . . . 71.409999999999997 114.345 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -101.38 117.76 35.6 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.691 0.396 . . . . 65.450000000000003 109.997 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.413 HG22 HG12 ' A' ' 46' ' ' ILE . 49.0 t -108.13 130.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 120.956 0.408 . . . . 74.230000000000004 112.047 -176.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -132.74 161.2 34.65 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.296 -0.411 . . . . 74.530000000000001 110.972 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 28.4 p90 -151.36 152.76 33.57 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.575 0.583 . . . . 74.409999999999997 112.575 -175.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 t -137.15 134.69 36.64 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.815 -0.63 . . . . 74.420000000000002 111.045 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.427 HD23 ' HE1' ' A' ' 15' ' ' PHE . 4.2 mm? -99.36 139.96 34.24 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.246 0.546 . . . . 73.400000000000006 112.3 -178.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -142.89 86.0 1.91 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.971 -0.558 . . . . 75.299999999999997 110.529 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.56 -89.76 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 121.367 -0.444 . . . . 70.129999999999995 113.481 -178.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -95.44 -25.76 16.12 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.691 0.397 . . . . 71.25 111.781 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -93.16 147.22 23.07 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.539 0.685 . . . . 75.219999999999999 112.659 -171.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -134.95 104.33 5.93 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.158 -0.928 . . . . 71.140000000000001 110.192 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.461 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.3 tt0 -94.35 111.08 22.8 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.701 0.286 . . . . 73.420000000000002 111.107 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -112.78 109.85 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-N 116.435 -0.348 . . . . 73.019999999999996 111.341 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.507 HH21 ' CD ' ' A' ' 2' ' ' GLU . 61.8 ttt180 -104.64 120.01 40.33 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.981 0.419 . . . . 74.540000000000006 111.145 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.413 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -106.95 125.89 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.936 0.398 . . . . 75.329999999999998 111.299 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' THR . . . . . 0.45 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -121.34 136.59 54.94 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.346 -0.388 . . . . 63.25 111.762 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.19 -13.94 40.24 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.755 -0.736 . . . . 71.239999999999995 114.193 174.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.35 138.1 95.72 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 117.268 0.534 . . . . 75.349999999999994 111.837 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.453 ' HG2' HG23 ' A' ' 53' ' ' VAL . 42.7 Cg_endo -68.8 152.6 73.91 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.382 2.055 . . . . 72.140000000000001 113.361 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -45.24 -43.11 10.12 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.836 1.05 . . . . 75.310000000000002 113.836 -176.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.21 -37.66 87.99 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.642 0.608 . . . . 70.400000000000006 112.642 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.524 HG13 ' HG ' ' A' ' 57' ' ' LEU . 57.6 t -73.89 -23.51 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.025 0.441 . . . . 74.200000000000003 111.708 -177.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.696 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 42.8 ttp180 -46.68 -50.52 17.71 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.334 0.588 . . . . 74.040000000000006 111.708 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . 0.414 ' CB ' ' HZ1' ' A' ' 55' ' ' LYS . 7.1 mtpm? -59.27 -44.77 92.42 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.244 -0.889 . . . . 73.420000000000002 112.029 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -68.95 -48.42 63.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.038 -0.528 . . . . 64.519999999999996 111.67 -175.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.524 ' HG ' HG13 ' A' ' 53' ' ' VAL . 87.1 mt -59.66 -33.85 72.08 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.555 0.217 . . . . 73.120000000000005 111.524 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.194 0.521 . . . . 61.310000000000002 110.594 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 ttpp -57.45 -45.46 84.73 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.752 -0.658 . . . . 74.450000000000003 111.226 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.98 95.67 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.49 -0.323 . . . . 74.340000000000003 111.79 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.37 -42.55 87.26 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.102 0.477 . . . . 75.230000000000004 111.291 177.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.29 -42.4 93.17 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.222 -0.444 . . . . 74.239999999999995 111.336 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -64.92 -37.96 89.37 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.734 0.302 . . . . 75.209999999999994 111.139 177.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.8 mt -57.38 -43.22 83.41 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.947 0.404 . . . . 72.319999999999993 110.65 172.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.98 -51.52 69.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.072 -0.513 . . . . 74.349999999999994 111.776 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -67.79 -26.24 65.99 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.222 0.453 . . . . 72.030000000000001 112.222 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.94 -50.56 72.97 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.949 0.404 . . . . 64.409999999999997 111.63 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -108.54 7.27 26.69 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.17 0.433 . . . . 74.200000000000003 112.17 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.8 t30 58.57 66.61 1.05 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.321 0.581 . . . . 74.430000000000007 111.356 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.8 pt -130.46 172.23 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 116.17 -0.468 . . . . 70.129999999999995 111.23 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.7 m -96.34 135.68 37.85 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.585 -0.279 . . . . 74.230000000000004 111.324 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.29 138.76 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.171 0.51 . . . . 75.230000000000004 112.118 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.6 p -127.43 172.87 10.28 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.999 -0.546 . . . . 63.32 109.742 172.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -145.92 115.77 7.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.364 0.602 . . . . 71.150000000000006 112.451 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 97.4 m -93.18 104.54 16.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.689 -0.687 . . . . 64.319999999999993 110.139 173.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.485 HG21 ' HD2' ' A' ' 54' ' ' ARG . 52.8 mt -111.93 129.42 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.947 0.403 . . . . 74.400000000000006 111.811 -175.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 121.177 0.513 . . . . 65.340000000000003 111.086 179.369 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.944 0.402 . . . . 73.530000000000001 111.358 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -115.11 148.02 39.49 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.244 -0.435 . . . . 74.409999999999997 110.949 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.504 ' HG3' HG12 ' A' ' 76' ' ' ILE . 27.1 ttt -130.6 107.69 9.37 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.182 0.515 . . . . 75.540000000000006 111.663 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 2.9 m-20 -81.91 104.6 12.39 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.875 -0.602 . . . . 72.129999999999995 111.158 176.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.7 mt -107.74 109.41 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 120.99 0.424 . . . . 70.239999999999995 111.281 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.73 107.06 18.16 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.568 -0.287 . . . . 73.140000000000001 111.549 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.03 138.56 31.3 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.553 -0.294 . . . . 74.109999999999999 110.226 172.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -137.54 120.29 16.28 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.806 0.336 . . . . 73.239999999999995 110.615 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.4 149.53 16.08 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.053 -0.594 . . . . 55.340000000000003 112.938 -178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.04 23.67 1.72 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 120.831 0.348 . . . . 63.310000000000002 111.648 -178.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -119.53 120.84 37.92 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 120.888 0.375 . . . . 72.420000000000002 111.393 -175.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 49.9 tp -72.23 -38.25 68.98 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.153 0.427 . . . . 71.329999999999998 112.153 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.45 -40.4 93.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.88 0.372 . . . . 74.340000000000003 111.221 178.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.4 -43.32 83.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.164 -0.471 . . . . 72.230000000000004 111.156 175.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.541 ' HE1' HD12 ' A' ' 42' ' ' LEU . 56.6 t80 -50.03 -55.31 15.28 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.684 -0.689 . . . . 75.209999999999994 111.577 176.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.64 -56.28 19.22 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.975 0.361 . . . . 73.129999999999995 111.975 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -61.97 -49.29 76.7 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.674 0.62 . . . . 71.239999999999995 112.674 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.46 -48.38 82.03 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.974 0.416 . . . . 74.439999999999998 111.574 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.9 tp -62.76 -43.39 98.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.045 0.45 . . . . 74.25 111.473 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -57.95 -47.85 81.68 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.88 -0.6 . . . . 75.140000000000001 111.763 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -66.66 -33.15 75.01 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.372 0.508 . . . . 72.040000000000006 112.372 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.405 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.4 mmm -66.07 -47.61 73.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.976 0.417 . . . . 73.420000000000002 110.895 176.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.71 -39.55 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 116.282 -0.417 . . . . 72.239999999999995 111.033 177.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.0 ttm-85 -54.58 -45.45 73.56 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.138 0.494 . . . . 73.040000000000006 111.204 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -72.45 -45.92 57.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.235 -0.439 . . . . 64.430000000000007 111.548 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.82 -34.96 70.22 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.245 0.461 . . . . 72.120000000000005 112.245 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -58.44 -28.72 65.55 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.043 0.386 . . . . 75.409999999999997 112.043 177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -66.21 -33.66 76.26 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.13 0.491 . . . . 74.409999999999997 111.228 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -96.54 -178.03 4.13 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.216 -0.447 . . . . 75.439999999999998 111.425 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.18 4.12 43.71 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.21 0.448 . . . . 72.129999999999995 112.21 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.91 159.62 42.02 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.186 -0.53 . . . . 50.32 113.812 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.7 m -119.1 144.49 46.58 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 122.609 -0.348 . . . . 73.310000000000002 110.767 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.405 HG21 HG12 ' A' ' 46' ' ' ILE . 64.5 t -117.7 124.43 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 112.036 0.384 . . . . 71.420000000000002 112.036 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -118.31 148.69 42.22 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.441 -0.345 . . . . 63.43 110.483 172.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -150.71 138.25 19.66 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.483 . . . . 74.0 112.138 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.2 p -123.88 119.78 30.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.09 -0.504 . . . . 65.0 110.808 176.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.4 tp -93.73 101.47 13.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.119 0.485 . . . . 74.140000000000001 111.629 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -99.04 96.88 8.1 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.122 -0.49 . . . . 74.219999999999999 110.773 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.64 -90.33 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.3 -0.476 . . . . 64.140000000000001 113.154 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -119.6 -1.04 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.855 0.36 . . . . 73.5 111.11 179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.15 121.81 44.59 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.273 -0.421 . . . . 75.400000000000006 111.396 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.541 HD12 ' HE1' ' A' ' 15' ' ' PHE . 64.6 tp -104.02 99.67 9.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.177 0.513 . . . . 73.420000000000002 110.659 176.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -85.28 104.52 15.2 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.215 -0.448 . . . . 72.340000000000003 111.197 179.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.5 mt -103.48 136.41 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.346 -0.388 . . . . 74.109999999999999 111.395 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -125.39 115.6 20.55 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.943 0.401 . . . . 73.019999999999996 110.771 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.405 HG12 HG21 ' A' ' 33' ' ' VAL . 51.6 mt -101.64 115.3 43.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.036 0.446 . . . . 74.209999999999994 110.689 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.9 m -101.43 123.68 45.88 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.284 -0.416 . . . . 74.129999999999995 111.6 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.22 65.01 1.22 Allowed Glycine 0 CA--C 1.527 0.798 0 C-N-CA 121.091 -0.576 . . . . 73.109999999999999 113.46 176.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.6 m -113.85 133.87 22.2 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 122.551 -0.382 . . . . 71.120000000000005 111.923 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.445 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 37.5 Cg_endo -65.57 125.78 14.98 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.578 2.186 . . . . 73.319999999999993 112.837 178.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -54.7 -34.44 62.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.483 0.549 . . . . 75.430000000000007 112.483 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.498 ' HG3' HG22 ' A' ' 53' ' ' VAL . 13.7 pt20 -63.92 -40.02 95.5 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.737 0.303 . . . . 65.310000000000002 111.763 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.498 HG22 ' HG3' ' A' ' 52' ' ' GLN . 58.4 t -86.75 -19.07 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.816 0.341 . . . . 74.239999999999995 111.498 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HD2' HD11 ' A' ' 76' ' ' ILE . 16.4 ttp180 -48.81 -36.35 16.55 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.287 0.477 . . . . 73.209999999999994 112.287 -178.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -61.42 -40.97 96.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.879 0.371 . . . . 71.230000000000004 111.481 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -69.84 -35.94 75.15 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.798 0.333 . . . . 70.450000000000003 111.042 177.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.44 -43.2 91.15 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.057 0.456 . . . . 75.439999999999998 110.853 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.53 94.43 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.243 0.544 . . . . 75.329999999999998 110.865 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 27.9 ttpt -59.64 -50.74 72.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.025 -0.534 . . . . 73.25 111.189 174.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -69.64 -37.8 76.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.94 -0.573 . . . . 71.019999999999996 111.713 -174.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.17 -51.82 55.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.042 0.449 . . . . 60.32 111.493 178.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 42.2 mt-10 -72.92 -31.49 64.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.484 -0.326 . . . . 64.319999999999993 111.357 176.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -48.67 78.33 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.882 0.372 . . . . 72.310000000000002 110.306 178.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.9 mt -52.79 -47.3 67.68 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.991 -0.549 . . . . 70.420000000000002 111.188 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.81 -42.06 83.46 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.051 -0.522 . . . . 75.540000000000006 111.874 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 62.1 mttm -68.64 -26.61 65.42 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.404 -0.362 . . . . 73.5 111.664 -178.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -68.55 -48.99 62.84 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.198 0.523 . . . . 72.329999999999998 111.198 174.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -96.14 1.33 52.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.487 0.551 . . . . 73.510000000000005 112.487 -175.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 61.72 26.17 15.88 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.084 0.401 . . . . 71.329999999999998 112.084 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -103.65 175.58 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 121.215 0.531 . . . . 75.519999999999996 112.425 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.8 m -97.3 139.73 32.83 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 112.042 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -146.37 137.28 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.978 0.418 . . . . 73.109999999999999 111.663 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.4 p -128.66 139.11 52.41 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 116.664 -0.244 . . . . 74.25 110.594 175.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . 0.502 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 43.5 p90 -127.27 119.38 26.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.363 0.601 . . . . 74.439999999999998 112.476 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 71.7 m -103.55 139.81 38.37 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.733 -0.667 . . . . 75.239999999999995 109.714 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.504 HG12 ' HG3' ' A' ' 3' ' ' MET . 56.3 mt -131.15 128.49 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 121.864 -0.522 . . . . 75.140000000000001 112.408 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 109.884 -0.413 . . . . 75.439999999999998 109.884 173.945 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.513 ' HE1' HG22 ' A' ' 49' ' ' VAL . 55.4 ttp . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 120.994 0.426 . . . . 72.150000000000006 111.532 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.07 146.3 51.06 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.573 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' MET . . . . . 0.464 ' HE2' HD12 ' A' ' 5' ' ' ILE . 21.0 ptm -131.65 121.95 25.15 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.9 0.704 . . . . 75.25 112.9 -175.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.552 ' HB3' ' NH1' ' A' ' 6' ' ' ARG . 3.8 m-20 -86.01 134.9 33.83 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.868 -0.605 . . . . 74.209999999999994 111.545 173.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.464 HD12 ' HE2' ' A' ' 3' ' ' MET . 59.3 mt -139.24 133.24 39.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.101 0.56 . . . . 73.329999999999998 110.055 173.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 0.552 ' NH1' ' HB3' ' A' ' 4' ' ' ASP . 49.9 mtt85 -132.84 113.23 12.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.974 0.416 . . . . 72.319999999999993 112.02 -175.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.519 ' HE1' ' SD ' ' A' ' 22' ' ' MET . 97.0 m-85 -93.25 142.55 27.19 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.305 -0.407 . . . . 70.530000000000001 110.9 177.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.1 ttt180 -142.37 127.13 18.12 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.536 0.208 . . . . 71.200000000000003 111.514 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.486 ' HA3' HG23 ' A' ' 70' ' ' ILE . . . -170.27 -175.37 39.07 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 120.842 -0.694 . . . . 74.120000000000005 113.948 -178.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -95.2 -50.88 4.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.986 0.365 . . . . 74.109999999999999 111.986 -176.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -61.36 114.48 3.22 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.9 0.381 . . . . 73.109999999999999 111.049 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.55 -50.42 73.86 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.645 0.609 . . . . 74.099999999999994 112.645 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 22.0 mt-10 -56.23 -25.42 47.43 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.855 0.687 . . . . 72.540000000000006 112.855 -178.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.08 -34.02 59.08 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.754 0.311 . . . . 74.319999999999993 111.608 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.488 ' HB3' HD22 ' A' ' 42' ' ' LEU . 78.6 m-85 -72.05 -60.2 2.35 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.505 -0.316 . . . . 74.519999999999996 111.476 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 10.9 pt-20 -57.67 -40.67 79.9 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.122 0.416 . . . . 73.340000000000003 112.122 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -70.21 -42.45 72.32 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.1 0.407 . . . . 74.010000000000005 112.1 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -46.72 82.48 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.211 0.529 . . . . 73.310000000000002 110.415 174.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.416 ' HB2' HD23 ' A' ' 42' ' ' LEU . 64.3 tp -56.05 -43.57 78.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.69 -0.686 . . . . 72.099999999999994 111.247 175.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -56.14 -46.11 79.36 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.062 -0.517 . . . . 74.409999999999997 111.498 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -65.99 -40.26 91.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.714 0.292 . . . . 73.530000000000001 111.677 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' MET . . . . . 0.519 ' SD ' ' HE1' ' A' ' 7' ' ' PHE . 80.8 mtp -61.37 -53.29 58.52 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.72 0.295 . . . . 74.019999999999996 111.202 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.604 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 69.1 mt -59.49 -42.31 87.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-O 120.931 0.396 . . . . 74.010000000000005 110.506 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -48.41 -50.34 31.4 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.948 -0.569 . . . . 65.310000000000002 111.562 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -75.14 -33.02 61.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.913 0.387 . . . . 71.230000000000004 111.663 178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -31.9 73.27 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.384 0.512 . . . . 61.350000000000001 112.384 -178.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 43.3 mtp180 -63.91 -27.84 69.42 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.93 0.395 . . . . 73.519999999999996 111.333 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -57.13 -25.03 58.17 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.136 -0.484 . . . . 75.219999999999999 111.486 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -120.16 167.74 11.92 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.988 0.423 . . . . 75.340000000000003 110.999 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.13 87.27 7.15 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.469 . . . . 74.209999999999994 110.748 176.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -146.42 157.68 27.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.836 -0.697 . . . . 73.310000000000002 113.474 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.9 m -106.98 128.81 54.68 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 122.793 -0.24 . . . . 74.109999999999999 111.276 -179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -110.6 109.38 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 120.77 0.319 . . . . 73.230000000000004 111.33 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.6 p -101.06 130.46 47.09 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.392 0.277 . . . . 72.209999999999994 110.286 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 47.5 p90 -144.01 150.2 37.88 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.66 0.615 . . . . 71.549999999999997 112.66 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -139.28 133.59 31.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.993 -0.548 . . . . 71.430000000000007 111.398 171.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.8 tp -95.28 106.33 18.35 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.018 0.437 . . . . 71.010000000000005 110.483 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -126.82 118.23 24.22 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.023 0.44 . . . . 71.430000000000007 111.411 -172.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.04 -101.4 0.6 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.338 -0.458 . . . . 74.400000000000006 113.049 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -122.1 6.1 9.77 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 71.430000000000007 111.089 176.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.82 139.51 49.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.357 0.598 . . . . 71.329999999999998 112.067 -176.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 15' ' ' PHE . 64.7 tp -108.02 101.72 10.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.102 -0.499 . . . . 74.329999999999998 109.84 172.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 7.9 tm-20 -81.52 115.04 20.64 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.925 -0.58 . . . . 74.510000000000005 110.556 -177.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -123.86 129.44 74.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 120.788 0.327 . . . . 74.209999999999994 111.616 -177.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -126.43 127.5 45.52 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 122.129 -0.357 . . . . 74.340000000000003 111.024 174.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.3 mt -111.89 124.22 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-O 120.976 0.417 . . . . 74.230000000000004 111.122 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -105.63 130.72 53.6 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.178 -0.465 . . . . 65.450000000000003 111.953 -177.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.67 28.47 8.89 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.197 -0.525 . . . . 61.549999999999997 113.832 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.513 HG22 ' HE1' ' A' ' 1' ' ' MET . 13.7 m -89.63 134.72 31.81 Favored Pre-proline 0 CA--C 1.543 0.703 0 O-C-N 122.41 -0.465 . . . . 71.319999999999993 111.974 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 8.1 Cg_exo -74.9 144.77 31.04 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.862 2.375 . . . . 62.100000000000001 113.023 177.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 3.1 tm-20 -53.2 -48.43 68.11 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 120.98 0.419 . . . . 72.340000000000003 111.28 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.421 ' HG3' HG23 ' A' ' 53' ' ' VAL . 20.6 pt20 -56.13 -28.63 58.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.367 0.506 . . . . 74.120000000000005 112.367 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.421 HG23 ' HG3' ' A' ' 52' ' ' GLN . 46.4 t -94.92 -22.87 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.965 0.412 . . . . 74.329999999999998 111.262 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.428 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 23.2 ttp180 -50.84 -49.4 58.94 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.142 0.496 . . . . 74.540000000000006 111.598 179.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -54.77 -40.84 69.79 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.573 -0.74 . . . . 75.319999999999993 111.968 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.5 -44.87 66.75 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.437 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.406 ' HG ' HG12 ' A' ' 53' ' ' VAL . 94.4 mt -63.98 -42.96 97.06 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.773 0.32 . . . . 73.310000000000002 111.77 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.95 -50.04 72.36 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.894 0.378 . . . . 65.519999999999996 111.136 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 2.7 tmmm? -56.72 -47.55 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.135 -0.484 . . . . 74.510000000000005 110.531 175.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.49 -40.63 87.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.155 -0.475 . . . . 72.129999999999995 110.96 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.41 -46.26 86.79 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.929 0.395 . . . . 71.329999999999998 111.488 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.67 -41.61 95.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.069 0.461 . . . . 62.439999999999998 111.049 176.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.66 -42.03 98.14 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.356 -0.384 . . . . 71.400000000000006 111.289 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.25 -48.31 79.19 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.997 0.427 . . . . 74.25 111.179 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.53 -55.63 23.89 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.011 -0.54 . . . . 71.340000000000003 111.321 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -60.25 -35.47 75.55 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.228 -0.442 . . . . 72.099999999999994 111.975 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.96 -46.53 88.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.138 0.494 . . . . 74.129999999999995 111.397 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.18 7.58 43.68 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.488 -0.324 . . . . 75.420000000000002 111.783 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t30 58.82 32.93 22.71 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.583 0.706 . . . . 73.540000000000006 111.058 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.486 HG23 ' HA3' ' A' ' 9' ' ' GLY . 20.3 pt -111.78 164.09 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 116.178 -0.464 . . . . 74.040000000000006 111.512 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 53.9 m -94.98 134.67 37.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.382 -0.372 . . . . 64.239999999999995 111.039 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.7 p -122.96 135.8 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 121.27 0.557 . . . . 74.319999999999993 112.202 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.6 p -128.84 141.34 51.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.053 -0.521 . . . . 73.439999999999998 110.008 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -139.72 160.87 38.9 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.608 0.596 . . . . 65.549999999999997 112.608 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.1 m -149.93 109.67 4.06 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.785 -0.643 . . . . 75.349999999999994 110.154 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -106.09 127.95 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 112.148 0.425 . . . . 74.150000000000006 112.148 -174.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 1' ' ' MET . 45.9 mtt180 . . . . . 0 N--CA 1.47 0.545 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 111.125 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.418 ' HE3' ' HA ' ' A' ' 51' ' ' GLU . 59.0 ttp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.809 0.338 . . . . 75.25 110.761 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.446 ' HG3' ' HA ' ' A' ' 47' ' ' THR . 4.5 mp0 -104.75 165.9 10.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.349 -0.387 . . . . 74.329999999999998 110.721 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.441 ' HE1' HG12 ' A' ' 5' ' ' ILE . 27.4 ttt -143.83 117.34 9.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.108 -0.37 . . . . 75.140000000000001 111.804 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 20.9 m-20 -94.62 103.85 15.79 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.812 0.339 . . . . 71.439999999999998 111.188 176.244 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.441 HG12 ' HE1' ' A' ' 3' ' ' MET . 47.5 mt -99.43 108.89 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.893 0.377 . . . . 71.230000000000004 110.563 176.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 58.0 mtp180 -99.94 107.21 19.12 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.604 -0.271 . . . . 74.129999999999995 111.497 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -90.35 126.58 35.92 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.796 0.331 . . . . 65.349999999999994 111.161 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.548 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 73.8 ttt-85 -127.06 120.12 28.22 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 110.067 -0.346 . . . . 74.549999999999997 110.067 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -142.57 -170.73 12.89 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 120.653 -0.784 . . . . 74.540000000000006 113.853 -172.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -103.9 -47.06 4.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.561 0.578 . . . . 72.409999999999997 112.561 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -100.83 152.79 20.1 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.961 -0.462 . . . . 73.430000000000007 111.688 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.97 -36.66 85.11 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.175 0.435 . . . . 72.439999999999998 112.175 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -58.53 -32.82 69.21 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.384 -0.371 . . . . 74.120000000000005 111.248 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.37 -45.48 80.5 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.063 0.459 . . . . 75.120000000000005 111.143 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -67.5 -47.05 71.12 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.142 0.496 . . . . 75.129999999999995 110.792 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -54.41 -57.94 9.37 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.723 -0.671 . . . . 71.420000000000002 112.14 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -65.33 -47.82 75.18 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.272 -0.422 . . . . 75.310000000000002 111.6 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.7 -51.2 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.403 . . . . 73.549999999999997 111.582 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.23 -45.06 88.39 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.139 0.495 . . . . 74.209999999999994 111.447 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -67.31 -31.73 72.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.141 -0.481 . . . . 74.299999999999997 111.752 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 27.0 mm-40 -70.18 -39.16 75.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.762 0.315 . . . . 73.310000000000002 111.444 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 90.5 mmm -59.93 -52.45 65.38 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.543 -0.299 . . . . 75.540000000000006 110.532 174.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.482 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 72.5 mt -58.02 -40.45 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.139 0.495 . . . . 70.140000000000001 111.209 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.402 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 68.9 ttt180 -48.52 -58.73 4.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.689 -0.687 . . . . 73.540000000000006 111.824 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -75.73 -39.22 57.63 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.41 0.522 . . . . 73.540000000000006 112.41 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.2 -30.03 59.11 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.563 0.579 . . . . 74.409999999999997 112.563 -175.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 74.9 mtp180 -59.87 -28.99 68.01 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.081 0.4 . . . . 75.140000000000001 112.081 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 12.7 mptt -74.16 -14.9 61.02 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.678 0.275 . . . . 74.540000000000006 111.56 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -110.79 149.47 30.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.84 0.352 . . . . 72.120000000000005 111.016 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.08 58.17 1.94 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.281 0.562 . . . . 61.299999999999997 111.559 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -131.0 133.15 7.13 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 116.107 -0.497 . . . . 75.549999999999997 112.276 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.4 m -85.97 117.83 25.06 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.857 0.361 . . . . 75.239999999999995 111.627 -176.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -92.31 109.59 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.229 0.538 . . . . 75.150000000000006 111.927 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.4 p -113.41 153.58 28.37 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.153 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -156.43 149.05 23.69 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.667 0.617 . . . . 73.400000000000006 112.667 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.1 p -130.29 126.57 37.57 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.637 -0.71 . . . . 70.209999999999994 110.811 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.1 tp -97.87 99.42 10.74 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.048 0.452 . . . . 75.040000000000006 110.926 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -106.18 106.66 17.28 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.967 0.413 . . . . 72.040000000000006 110.838 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 60.7 -112.92 5.03 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.12 -0.562 . . . . 63.329999999999998 112.335 -175.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.466 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 47.3 t-20 -115.67 72.3 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.03 0.443 . . . . 72.219999999999999 110.175 173.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -175.99 122.28 0.18 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.576 -0.738 . . . . 63.450000000000003 109.785 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.2 tp -104.74 101.14 10.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 72.010000000000005 111.047 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -85.09 104.45 15.01 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.472 -0.331 . . . . 75.200000000000003 111.095 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.9 mt -99.6 109.07 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 111.773 0.286 . . . . 74.409999999999997 111.773 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -98.87 106.23 18.47 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.185 0.517 . . . . 72.540000000000006 111.578 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.9 mt -91.8 112.01 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 116.184 -0.462 . . . . 73.340000000000003 110.298 174.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.446 ' HA ' ' HG3' ' A' ' 2' ' ' GLU . 91.7 m -93.04 120.44 33.34 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.218 -0.446 . . . . 71.019999999999996 112.0 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.87 65.13 1.09 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.434 -0.412 . . . . 72.409999999999997 113.922 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 16.4 m -122.06 136.56 26.4 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 122.405 -0.468 . . . . 74.540000000000006 111.914 177.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -78.65 150.8 24.72 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.598 2.199 . . . . 73.140000000000001 112.461 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.418 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 12.1 pt-20 -60.06 -30.63 69.34 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.852 0.686 . . . . 64.230000000000004 112.852 -174.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.421 ' HG3' HG23 ' A' ' 53' ' ' VAL . 28.9 pt20 -63.58 -45.62 89.59 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.948 0.404 . . . . 74.420000000000002 111.308 177.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.421 HG23 ' HG3' ' A' ' 52' ' ' GLN . 61.3 t -77.08 -27.72 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.869 0.366 . . . . 65.239999999999995 111.109 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.2 ttp180 -48.94 -40.98 32.38 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.161 0.505 . . . . 71.430000000000007 111.193 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -60.91 -51.84 67.58 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.822 -0.626 . . . . 71.420000000000002 111.311 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -62.09 -44.65 96.19 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.828 -0.624 . . . . 75.329999999999998 112.097 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.31 -45.68 75.79 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.771 0.319 . . . . 71.409999999999997 111.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.91 94.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.059 0.457 . . . . 73.439999999999998 111.508 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -72.27 -34.89 68.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.156 -0.475 . . . . 65.230000000000004 112.064 -178.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -71.39 -31.99 67.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.262 -0.575 . . . . 74.299999999999997 110.566 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.09 -44.09 78.67 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.951 0.405 . . . . 72.299999999999997 110.498 171.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -58.1 -50.0 74.99 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.335 0.588 . . . . 70.239999999999995 110.43 172.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 13.5 tpt180 -53.41 -48.77 68.4 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.347 -0.842 . . . . 72.329999999999998 111.475 179.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.73 -50.69 72.39 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.182 0.515 . . . . 71.510000000000005 111.046 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.39 65.69 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.09 -0.504 . . . . 72.430000000000007 111.868 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -74.38 -59.8 2.56 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 122.372 -0.205 . . . . 75.319999999999993 111.463 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -35.45 70.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.304 0.483 . . . . 72.310000000000002 112.304 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -92.79 -6.87 48.0 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.185 -0.322 . . . . 74.25 111.8 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.1 t30 57.93 15.83 3.34 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.395 0.617 . . . . 73.140000000000001 111.828 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.1 pt -87.1 174.88 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.051 0.453 . . . . 71.409999999999997 111.84 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.1 m -90.01 139.06 30.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.196 -0.456 . . . . 75.409999999999997 111.317 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.2 p -135.67 126.6 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.183 0.516 . . . . 74.040000000000006 111.472 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 71.8 p -129.64 120.53 25.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.419 -0.355 . . . . 70.549999999999997 110.333 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -121.22 117.79 27.97 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.063 0.459 . . . . 75.439999999999998 112.019 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.8 m -98.82 116.86 31.99 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.902 0.382 . . . . 74.530000000000001 111.037 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.6 mm -82.0 112.37 19.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 116.446 -0.343 . . . . 74.5 111.041 179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 77' ' ' ARG . 19.3 mmm180 -78.86 101.6 7.76 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.936 0.398 . . . . 72.519999999999996 110.552 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.0 131.94 35.91 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.459 0.54 . . . . 72.219999999999999 112.459 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -65.04 116.39 6.4 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.84 -0.618 . . . . 75.540000000000006 109.8 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -121.31 168.37 11.71 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.707 0.632 . . . . 72.129999999999995 112.707 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -168.67 117.4 0.7 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.593 -0.73 . . . . 71.140000000000001 110.728 -177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -62.04 93.92 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.92 0.39 . . . . 73.450000000000003 110.731 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -63.13 163.82 9.51 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.008 0.744 . . . . 73.219999999999999 113.008 -176.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -98.41 -39.92 8.54 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 111.215 176.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 35.8 p80 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 119.268 -0.396 . . . . 73.540000000000006 111.674 179.845 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.468 ' HG2' HD11 ' A' ' 78' ' ' LEU . 75.3 mtm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.779 0.323 . . . . 74.030000000000001 111.468 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.566 ' HB2' ' HG3' ' A' ' 77' ' ' ARG . 39.8 mt-10 -124.32 163.09 22.42 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.281 0.563 . . . . 72.510000000000005 111.862 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.67 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 25.7 ttt -143.59 111.95 6.34 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.061 -0.518 . . . . 74.140000000000001 111.613 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.43 120.78 28.13 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.661 0.267 . . . . 71.319999999999993 111.043 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' A' ' 44' ' ' ILE . 22.5 mt -124.64 147.64 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.876 0.37 . . . . 73.129999999999995 111.814 -174.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.05 110.37 8.44 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.429 -0.35 . . . . 74.510000000000005 110.987 170.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -89.28 124.18 34.17 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.825 -0.435 . . . . 71.239999999999995 109.825 172.057 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.445 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 58.2 ttt180 -124.24 125.44 44.4 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.024 0.44 . . . . 75.519999999999996 111.852 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 170.76 -168.12 41.24 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.846 -0.692 . . . . 61.299999999999997 113.608 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -123.07 90.17 3.24 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 122.666 0.386 . . . . 74.430000000000007 110.852 -179.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -175.95 142.26 0.51 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.149 -0.478 . . . . 63.240000000000002 110.372 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 35.0 tp -89.28 -39.63 13.35 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 111.853 0.316 . . . . 74.409999999999997 111.853 -176.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -66.66 -32.26 73.46 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 122.17 -0.331 . . . . 73.319999999999993 111.251 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.69 -41.91 70.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.057 0.456 . . . . 74.129999999999995 110.909 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.455 ' CD1' HD23 ' A' ' 42' ' ' LEU . 62.4 t80 -58.83 -56.74 18.27 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.797 -0.638 . . . . 73.230000000000004 111.502 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.08 -52.33 63.11 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.144 0.424 . . . . 71.409999999999997 112.144 -176.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -62.43 -54.59 38.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.763 0.653 . . . . 74.530000000000001 112.763 -176.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.447 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -58.15 -43.86 87.59 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.92 0.391 . . . . 75.230000000000004 111.558 -178.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.2 tp -66.81 -42.54 85.75 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.975 0.417 . . . . 74.230000000000004 111.327 177.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -59.33 -52.77 64.23 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.155 -0.475 . . . . 75.329999999999998 111.985 -177.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -60.93 -49.59 76.85 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.203 0.445 . . . . 74.209999999999994 112.203 -176.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 51.4 mtp -62.94 -40.81 98.78 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.739 0.274 . . . . 63.350000000000001 111.739 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.3 mt -64.16 -41.92 93.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 120.974 0.416 . . . . 74.230000000000004 110.624 174.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.3 -46.53 79.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.061 -0.518 . . . . 74.109999999999999 111.136 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.56 ' O ' ' HG2' ' A' ' 28' ' ' LYS . 29.7 mt-30 -74.3 -36.11 63.72 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.308 0.484 . . . . 72.030000000000001 112.308 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.86 -47.1 87.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.934 -0.479 . . . . 73.310000000000002 111.618 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -59.63 -39.49 84.49 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.744 0.646 . . . . 72.450000000000003 112.744 -177.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.56 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 20.8 ptmt -69.37 -14.33 62.85 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.987 0.422 . . . . 75.129999999999995 111.372 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -108.43 15.18 24.15 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.445 -0.343 . . . . 75.040000000000006 111.119 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.88 16.81 10.63 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.532 0.567 . . . . 74.540000000000006 112.532 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -78.43 133.31 12.61 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 121.442 -0.409 . . . . 52.130000000000003 113.587 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.7 m -90.85 122.5 33.61 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.542 -0.387 . . . . 75.540000000000006 111.117 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.433 HG21 HG12 ' A' ' 46' ' ' ILE . 49.9 t -109.03 130.17 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 120.96 0.41 . . . . 72.540000000000006 111.871 -179.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.9 t -124.64 132.79 53.4 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.519 -0.309 . . . . 74.420000000000002 110.794 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.514 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.7 p90 -128.34 144.92 51.19 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.369 0.507 . . . . 73.209999999999994 112.369 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 37.8 p -137.84 133.24 33.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.96 -0.564 . . . . 74.040000000000006 111.13 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.55 115.44 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.747 0.308 . . . . 74.430000000000007 111.31 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -114.21 81.39 1.53 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.383 0.611 . . . . 65.230000000000004 111.496 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.72 -85.09 0.03 OUTLIER Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.814 0.685 . . . . 55.310000000000002 114.814 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -100.06 -10.74 21.21 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.473 0.546 . . . . 51.310000000000002 112.473 -171.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -146.51 160.87 41.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.065 0.765 . . . . 71.420000000000002 113.065 -175.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.514 HD11 ' HB2' ' A' ' 35' ' ' TYR . 50.6 tp -101.49 116.31 32.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.501 -0.772 . . . . 74.109999999999999 111.883 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.418 ' HB2' ' OG1' ' A' ' 36' ' ' THR . 38.0 mt-10 -79.83 129.96 34.92 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.536 -0.302 . . . . 72.200000000000003 110.725 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.453 ' HB ' ' HB ' ' A' ' 5' ' ' ILE . 66.5 mt -134.58 121.86 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 122.407 0.283 . . . . 74.409999999999997 111.069 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.486 ' HA ' ' O ' ' A' ' 3' ' ' MET . 42.5 ttm180 -118.66 120.84 38.63 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.073 0.463 . . . . 63.530000000000001 111.032 174.559 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.485 ' O ' ' HA ' ' A' ' 2' ' ' GLU . 49.7 mt -101.49 129.08 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 116.121 -0.49 . . . . 74.519999999999996 110.777 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.431 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 57.5 m -120.89 143.39 48.95 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.313 0.245 . . . . 75.340000000000003 111.6 -176.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.44 10.91 60.14 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.119 -0.562 . . . . 72.25 114.396 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.458 HG21 ' HE ' ' A' ' 54' ' ' ARG . 19.2 m -89.39 136.4 29.98 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 117.32 0.56 . . . . 74.430000000000007 112.077 179.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -73.09 174.32 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.976 2.451 . . . . 73.150000000000006 113.316 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.448 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 13.7 pt-20 -66.42 -49.38 66.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.624 0.972 . . . . 75.540000000000006 113.624 -171.335 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.21 -41.48 85.7 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.883 -0.51 . . . . 75.209999999999994 111.262 -176.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.59 -31.45 48.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.182 0.515 . . . . 70.310000000000002 110.992 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.67 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 3.8 tpm_? -52.51 -43.26 64.97 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 72.430000000000007 111.321 176.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.85 -52.85 62.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.811 -0.631 . . . . 73.150000000000006 111.68 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.74 -43.06 99.58 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.254 -0.43 . . . . 65.349999999999994 111.86 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.81 -36.77 84.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.961 0.41 . . . . 73.400000000000006 111.491 176.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.451 ' HA ' ' HE2' ' A' ' 3' ' ' MET . . . -65.9 -30.26 70.82 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.993 0.425 . . . . 70.439999999999998 111.328 176.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -78.3 -34.59 48.7 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 116.284 -0.416 . . . . 71.409999999999997 111.452 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.73 -41.49 97.71 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.776 0.287 . . . . 65.25 111.776 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -51.06 -43.59 60.99 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.103 0.478 . . . . 72.409999999999997 111.716 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.65 -41.68 95.48 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 111.416 176.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.446 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.1 tpt180 -62.71 -52.95 61.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.044 -0.526 . . . . 75.049999999999997 110.937 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.447 HD23 ' HA ' ' A' ' 18' ' ' ALA . 86.4 mt -50.14 -48.54 53.68 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.89 -0.595 . . . . 74.010000000000005 111.998 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.43 ' HB3' ' HB ' ' A' ' 72' ' ' VAL . . . -58.78 -52.65 64.83 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.025 -0.534 . . . . 74.420000000000002 111.873 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -62.64 -35.05 78.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.601 0.593 . . . . 73.150000000000006 112.601 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.6 mm-40 -55.25 -47.69 75.06 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.251 0.548 . . . . 63.450000000000003 111.231 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -93.93 7.6 44.4 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.101 -0.499 . . . . 73.329999999999998 111.76 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.11 31.39 20.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.424 0.63 . . . . 71.310000000000002 111.559 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.5 pt -105.54 171.69 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.046 0.451 . . . . 64.340000000000003 111.23 177.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.445 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 47.8 p -97.99 143.04 28.97 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.928 0.394 . . . . 74.5 111.601 -179.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.43 ' HB ' ' HB3' ' A' ' 65' ' ' ALA . 11.1 p -128.62 120.75 53.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.488 0.661 . . . . 62.140000000000001 111.986 176.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.5 p -116.09 136.01 53.42 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.761 -0.654 . . . . 75.299999999999997 110.178 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -149.39 155.07 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.014 0.746 . . . . 75.099999999999994 113.014 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 49.8 m -131.82 132.04 43.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.524 -0.762 . . . . 72.439999999999998 110.644 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.408 HD11 HH11 ' A' ' 54' ' ' ARG . 41.8 mm -94.15 122.11 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.575 0.226 . . . . 74.150000000000006 111.168 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.566 ' HG3' ' HB2' ' A' ' 2' ' ' GLU . 14.9 ptm180 -113.53 130.85 56.27 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.482 0.658 . . . . 74.099999999999994 112.259 179.315 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.468 HD11 ' HG2' ' A' ' 1' ' ' MET . 16.7 tp -140.0 143.81 36.65 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.258 -0.883 . . . . 72.439999999999998 110.835 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -67.4 86.79 0.18 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.213 0.53 . . . . 74.209999999999994 111.002 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -96.19 121.71 38.25 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.021 -0.536 . . . . 72.349999999999994 111.484 -176.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -64.49 135.57 56.19 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.258 0.551 . . . . 73.140000000000001 111.185 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -121.9 106.33 11.15 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.061 -0.518 . . . . 73.349999999999994 111.293 -175.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -125.17 113.36 17.58 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.991 0.424 . . . . 74.319999999999993 111.501 -177.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -78.09 159.76 28.49 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.241 -0.436 . . . . 75.219999999999999 111.419 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 . . . . . 0 C--O 1.252 1.214 0 CA-C-N 116.644 -0.253 . . . . 71.25 111.051 175.148 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 tmm? . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.826 0.346 . . . . 64.310000000000002 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -109.66 146.25 35.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.314 -0.403 . . . . 71.319999999999993 111.043 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.509 ' HE1' HD12 ' A' ' 5' ' ' ILE . 17.8 ptm -144.36 119.09 9.83 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.825 0.345 . . . . 75.329999999999998 111.928 -176.803 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.82 130.79 38.31 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.292 -0.413 . . . . 73.129999999999995 111.188 177.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.509 HD12 ' HE1' ' A' ' 3' ' ' MET . 57.2 mt -132.95 112.84 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.376 -0.203 . . . . 71.239999999999995 111.38 179.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.409 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 51.8 mtp180 -102.73 121.74 43.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.861 0.362 . . . . 65.439999999999998 111.765 -179.089 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -101.39 126.04 48.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.342 -0.39 . . . . 73.420000000000002 111.532 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -140.14 132.67 28.67 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.536 -0.302 . . . . 75.209999999999994 110.79 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.474 ' HA3' ' HB ' ' A' ' 70' ' ' ILE . . . 168.9 -173.68 43.45 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 119.977 -1.106 . . . . 75.409999999999997 114.72 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 2.5 m-20 -87.35 85.75 7.19 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.297 0.48 . . . . 65.140000000000001 112.297 -175.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.43 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 8.5 t70 178.77 164.92 0.84 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.968 0.507 . . . . 74.209999999999994 109.992 174.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.0 tp -113.76 -44.62 3.16 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.949 0.404 . . . . 75.319999999999993 111.035 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.55 -25.66 68.34 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.374 -0.376 . . . . 74.239999999999995 111.152 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.27 -29.03 30.85 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.81 0.338 . . . . 71.409999999999997 111.51 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -57.11 -60.15 4.03 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.133 0.492 . . . . 71.519999999999996 111.067 174.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.507 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 11.7 pt-20 -69.54 -38.56 77.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.319 -0.401 . . . . 72.510000000000005 111.567 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.443 ' HG3' ' HZ ' ' A' ' 68' ' ' PHE . 24.1 mmmt -56.75 -54.22 48.79 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 74.129999999999995 112.075 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.22 69.36 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.919 0.39 . . . . 72.230000000000004 111.846 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.7 -49.48 72.94 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.164 0.431 . . . . 53.399999999999999 112.164 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.0 tptp -61.37 -50.63 72.12 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.819 0.342 . . . . 75.540000000000006 111.672 -174.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -62.14 -43.82 98.0 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.0 0.37 . . . . 73.109999999999999 112.0 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -59.83 -45.38 92.56 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.631 0.253 . . . . 64.349999999999994 111.211 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.0 mt -63.26 -42.4 96.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.96 0.41 . . . . 74.010000000000005 110.918 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.28 -39.09 74.97 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.08 -0.509 . . . . 71.510000000000005 111.156 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -75.77 -50.2 15.94 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.072 0.397 . . . . 72.239999999999995 112.072 174.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.63 84.91 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.009 0.744 . . . . 75.5 113.009 -175.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.95 58.97 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.733 0.301 . . . . 73.150000000000006 111.701 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -54.86 -33.09 61.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.198 0.523 . . . . 74.510000000000005 111.073 175.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -111.91 -168.23 1.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.953 -0.567 . . . . 72.129999999999995 111.227 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 16.98 2.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.95 0.405 . . . . 73.519999999999996 111.778 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.84 108.19 2.78 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.452 -0.404 . . . . 52.299999999999997 113.331 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -82.9 135.49 34.9 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.8 -0.235 . . . . 72.140000000000001 110.988 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.6 t -113.28 125.32 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 112.256 0.465 . . . . 72.319999999999993 112.256 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 t -122.57 152.5 40.35 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.129 -0.487 . . . . 70.310000000000002 110.445 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.5 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 38.1 p90 -144.63 141.71 29.58 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.361 0.504 . . . . 71.319999999999993 112.361 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.0 p -133.91 135.8 43.85 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.287 -0.415 . . . . 71.409999999999997 111.152 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -87.58 127.56 35.26 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.596 0.236 . . . . 62.130000000000003 111.53 179.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -123.16 94.15 4.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.132 0.492 . . . . 74.310000000000002 111.645 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.78 -75.54 0.72 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.303 -0.475 . . . . 74.540000000000006 113.718 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -139.75 11.38 2.47 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.523 0.564 . . . . 73.129999999999995 112.523 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -137.47 159.97 40.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.392 0.615 . . . . 75.219999999999999 112.446 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.494 HD12 ' HB2' ' A' ' 35' ' ' TYR . 58.0 tp -105.7 119.21 38.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.667 -0.697 . . . . 64.340000000000003 111.823 -179.263 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.5 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 29.7 mt-10 -91.18 104.14 16.74 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.459 -0.337 . . . . 64.030000000000001 111.233 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.49 109.61 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 120.691 0.281 . . . . 74.099999999999994 111.578 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.414 HH11 ' HD3' ' A' ' 45' ' ' ARG . 31.1 ttp180 -110.93 125.99 54.25 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.076 0.465 . . . . 72.030000000000001 111.666 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.0 mt -108.12 139.53 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 116.415 -0.357 . . . . 75.129999999999995 110.808 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.8 m -120.42 130.61 54.42 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.386 0.513 . . . . 72.049999999999997 112.386 -175.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.75 40.53 45.15 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.907 0.723 . . . . 64.430000000000007 114.907 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.8 m -95.23 152.85 39.69 Favored Pre-proline 0 N--CA 1.469 0.516 0 O-C-N 122.302 -0.529 . . . . 74.530000000000001 111.592 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.464 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 11.3 Cg_endo -55.11 117.16 3.72 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.779 2.319 . . . . 74.430000000000007 112.724 176.222 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.434 ' O ' ' HB3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.39 -29.97 11.29 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.955 0.724 . . . . 72.209999999999994 112.955 -178.001 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 55' ' ' LYS . 29.8 pt20 -76.11 -46.59 28.08 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.142 0.423 . . . . 73.409999999999997 112.142 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.464 ' HB ' ' HG2' ' A' ' 50' ' ' PRO . 58.8 t -67.61 -19.94 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-O 121.31 0.576 . . . . 72.150000000000006 110.844 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.434 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 7.0 ttp180 -46.17 -33.58 3.69 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.688 -0.687 . . . . 73.420000000000002 112.374 175.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.454 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 17.1 ptpt -60.29 -45.11 94.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.715 0.293 . . . . 72.510000000000005 111.455 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -74.84 -34.15 62.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.744 0.307 . . . . 73.540000000000006 111.18 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.36 -48.38 78.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.906 0.384 . . . . 73.049999999999997 111.248 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.04 -38.97 83.14 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.082 0.468 . . . . 70.150000000000006 110.982 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -58.77 -43.46 90.4 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.805 -0.634 . . . . 73.430000000000007 111.136 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -60.26 -42.35 95.17 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.124 -0.489 . . . . 73.5 110.996 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.446 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -53.84 -49.03 69.33 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.967 0.413 . . . . 72.510000000000005 111.618 177.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.34 -36.37 83.49 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.072 0.463 . . . . 52.229999999999997 111.259 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -69.08 -37.01 78.23 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.358 -0.383 . . . . 75.209999999999994 111.333 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.446 HD12 ' HA ' ' A' ' 61' ' ' ALA . 79.7 mt -59.57 -44.01 93.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.277 0.56 . . . . 72.010000000000005 110.223 174.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.88 -48.55 81.29 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.78 -0.646 . . . . 64.420000000000002 111.038 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -60.58 -33.79 73.24 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.306 0.484 . . . . 72.230000000000004 112.306 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -57.56 -36.86 72.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.12 0.486 . . . . 75.099999999999994 111.049 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.443 ' HZ ' ' HG3' ' A' ' 17' ' ' LYS . 85.4 m-85 -111.05 7.06 21.34 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.204 -0.453 . . . . 74.049999999999997 111.25 177.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 55.58 28.51 11.99 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.06 0.544 . . . . 74.319999999999993 112.151 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.474 ' HB ' ' HA3' ' A' ' 9' ' ' GLY . 32.2 pt -95.18 -178.25 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 112.675 0.62 . . . . 75.109999999999999 112.675 -176.376 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.1 m -91.79 141.37 28.74 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.97 -0.559 . . . . 73.400000000000006 111.694 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.41 118.71 23.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.041 0.448 . . . . 63.509999999999998 111.237 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -115.22 120.84 41.05 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.266 -0.271 . . . . 64.340000000000003 110.469 177.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -127.92 137.3 52.24 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.301 0.572 . . . . 62.420000000000002 112.308 -175.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.0 m -113.74 111.67 22.18 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.001 -0.545 . . . . 71.010000000000005 110.822 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -123.03 116.01 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.725 0.297 . . . . 74.239999999999995 111.312 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -117.67 119.42 34.9 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 122.522 0.329 . . . . 75.430000000000007 110.757 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.446 HD22 ' N ' ' A' ' 78' ' ' LEU . 3.0 mm? -89.11 164.64 14.94 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.22 0.533 . . . . 73.430000000000007 112.016 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 147.26 40.8 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.185 -0.462 . . . . 71.409999999999997 110.501 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -128.12 -48.52 1.33 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.483 0.549 . . . . 73.540000000000006 112.483 -174.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 74.9 t60 50.46 25.27 1.87 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.775 1.028 . . . . 73.200000000000003 113.775 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -55.67 115.34 2.29 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.45 -0.782 . . . . 73.439999999999998 111.336 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -74.15 132.45 42.24 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.018 0.437 . . . . 74.219999999999999 111.656 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 34.7 p80 -108.32 -179.11 3.79 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.191 -0.459 . . . . 74.239999999999995 111.45 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 31.3 m170 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 119.017 -0.516 . . . . 75.450000000000003 110.894 174.385 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.84 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.9 mtp . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.01 0.433 . . . . 62.200000000000003 111.382 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HB3' ' HB2' ' A' ' 77' ' ' ARG . 0.6 OUTLIER -122.51 119.11 29.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.791 -0.818 . . . . 74.319999999999993 108.791 178.098 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.574 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.0 ttt -124.38 122.21 37.06 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.017 1.117 . . . . 75.510000000000005 114.017 -165.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.488 ' HB3' ' O ' ' A' ' 75' ' ' THR . 1.0 OUTLIER -89.61 123.94 34.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.314 -0.857 . . . . 72.299999999999997 110.272 171.415 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 41.0 mt -130.4 108.73 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.958 0.409 . . . . 74.5 111.257 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -109.49 108.04 18.38 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.428 0.529 . . . . 71.340000000000003 112.428 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -89.84 156.04 18.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.836 -0.62 . . . . 74.140000000000001 110.708 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.528 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 42.1 ttp180 -142.42 120.4 12.06 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.171 0.51 . . . . 73.430000000000007 111.387 171.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.94 131.53 2.38 Favored Glycine 0 CA--C 1.522 0.507 0 CA-C-N 115.826 -0.625 . . . . 40.240000000000002 112.493 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.68 -5.44 55.15 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 122.427 -0.455 . . . . 64.430000000000007 111.654 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -73.02 101.22 3.18 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 73.010000000000005 110.709 174.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 30.4 tp -61.97 -26.98 68.53 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.046 0.387 . . . . 74.230000000000004 112.046 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -73.44 -36.35 65.89 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.024 -0.423 . . . . 73.400000000000006 110.527 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.74 -31.75 72.6 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.819 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.438 ' HE1' HD12 ' A' ' 42' ' ' LEU . 60.6 t80 -55.26 -48.17 74.38 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.114 0.483 . . . . 75.209999999999994 110.331 171.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 9.0 tm-20 -60.45 -50.42 73.66 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.824 -0.626 . . . . 75.409999999999997 110.86 176.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -56.63 -54.35 47.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.403 0.52 . . . . 75.549999999999997 112.403 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.511 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -56.17 -53.36 58.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.891 0.33 . . . . 70.200000000000003 111.891 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.48 -36.74 83.45 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.061 0.458 . . . . 73.519999999999996 110.786 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.9 tptm -59.03 -51.05 71.72 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.041 -0.527 . . . . 72.340000000000003 111.73 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.542 ' HG3' HD22 ' A' ' 64' ' ' LEU . 7.8 mm-40 -61.65 -47.52 85.0 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.913 -0.585 . . . . 75.439999999999998 111.82 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.511 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 51.3 mmm -61.88 -40.38 95.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.781 0.324 . . . . 74.310000000000002 111.301 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.0 mt -67.79 -37.58 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 120.787 0.327 . . . . 72.209999999999994 110.867 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.459 HH21 ' CD ' ' A' ' 21' ' ' GLU . 60.2 ttp85 -54.91 -42.5 72.25 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.884 0.373 . . . . 74.310000000000002 111.094 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -74.19 -48.04 31.73 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.951 0.405 . . . . 74.319999999999993 111.509 175.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.77 -46.66 71.04 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.752 0.649 . . . . 71.450000000000003 112.752 -175.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -56.4 -34.3 66.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.603 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -72.84 -32.63 65.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.072 0.463 . . . . 71.299999999999997 111.372 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.414 ' CZ ' HG13 ' A' ' 53' ' ' VAL . 24.9 m-85 -96.35 -6.28 38.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.321 -0.399 . . . . 74.349999999999994 111.854 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 62.12 27.21 16.4 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.126 0.489 . . . . 72.030000000000001 111.516 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.94 156.87 36.75 Favored Glycine 0 CA--C 1.527 0.802 0 CA-C-N 116.126 -0.488 . . . . 74.120000000000005 113.262 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 78.0 m -88.32 128.66 35.49 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.731 -0.276 . . . . 74.219999999999999 110.949 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.509 HG21 HG12 ' A' ' 46' ' ' ILE . 61.1 t -123.78 114.47 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 121.047 0.451 . . . . 75.129999999999995 112.054 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.8 t -106.53 154.4 20.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.274 -0.421 . . . . 70.430000000000007 110.464 173.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.584 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 41.1 p90 -145.67 138.08 25.66 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.094 0.473 . . . . 74.230000000000004 112.144 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.8 p -132.9 134.43 44.56 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.119 -0.491 . . . . 74.519999999999996 111.049 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.57 100.91 12.32 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.777 0.322 . . . . 72.439999999999998 111.133 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -97.61 97.58 9.17 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.828 0.346 . . . . 73.040000000000006 110.864 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 -78.04 0.13 Allowed Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.357 -0.449 . . . . 62.240000000000002 113.055 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -143.31 15.81 1.86 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.541 -0.388 . . . . 74.120000000000005 111.342 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.447 ' OD2' ' HD3' ' A' ' 8' ' ' ARG . 3.9 m-20 -107.17 128.67 54.61 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.217 -0.447 . . . . 74.450000000000003 111.211 177.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.438 HD12 ' HE1' ' A' ' 15' ' ' PHE . 46.8 tp -95.5 101.72 13.46 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.278 0.561 . . . . 73.25 111.358 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.584 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.7 tt0 -89.53 107.18 18.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.108 -0.497 . . . . 74.530000000000001 111.642 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.8 mt -113.07 117.62 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 122.624 0.369 . . . . 73.329999999999998 110.88 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.461 ' HG2' ' HA ' ' A' ' 4' ' ' ASP . 74.0 mtt180 -116.86 122.92 45.75 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.823 -0.548 . . . . 75.040000000000006 111.865 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.509 HG12 HG21 ' A' ' 33' ' ' VAL . 51.2 mt -110.0 115.06 48.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.995 -0.548 . . . . 73.230000000000004 111.593 -176.162 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.415 HG23 ' HG2' ' A' ' 2' ' ' GLU . 60.4 m -100.48 127.01 46.94 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.116 -0.493 . . . . 74.230000000000004 111.548 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.43 57.29 1.13 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 121.152 -0.547 . . . . 62.439999999999998 113.627 175.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.483 HG22 ' HB2' ' A' ' 1' ' ' MET . 18.5 m -118.11 138.73 25.81 Favored Pre-proline 0 CA--C 1.541 0.63 0 CA-C-O 120.748 0.309 . . . . 71.319999999999993 111.445 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.46 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 16.8 Cg_exo -68.14 140.46 49.49 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.008 2.472 . . . . 75.430000000000007 113.389 -177.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.84 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 11.6 pt-20 -54.64 -41.08 69.63 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.73 0.641 . . . . 54.140000000000001 112.73 -178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -66.14 -24.09 66.6 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.271 0.471 . . . . 74.530000000000001 112.271 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.518 HG12 ' HG ' ' A' ' 57' ' ' LEU . 40.1 t -84.53 -10.19 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-O 120.912 0.387 . . . . 75.040000000000006 111.684 -177.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -43.73 -45.17 6.99 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.641 0.377 . . . . 75.25 111.989 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.96 -31.44 72.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.157 -0.474 . . . . 74.200000000000003 111.836 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -77.07 -53.85 7.27 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.873 0.368 . . . . 70.510000000000005 111.694 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.518 ' HG ' HG12 ' A' ' 53' ' ' VAL . 82.5 mt -56.0 -53.52 55.9 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.582 0.586 . . . . 75.430000000000007 112.582 -174.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.18 -40.6 94.5 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.966 0.413 . . . . 72.319999999999993 111.51 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -62.66 -40.94 98.62 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.319 -0.4 . . . . 73.319999999999993 111.539 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -74.2 -34.8 63.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.826 0.346 . . . . 75.310000000000002 111.262 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.71 -47.49 85.43 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.911 0.386 . . . . 72.140000000000001 110.879 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.48 -31.47 71.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.43 -0.35 . . . . 73.120000000000005 111.34 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -55.59 -53.37 57.35 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.981 -0.377 . . . . 74.420000000000002 109.981 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.542 HD22 ' HG3' ' A' ' 21' ' ' GLU . 54.4 mt -49.87 -43.08 49.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.925 -0.579 . . . . 74.420000000000002 112.047 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -57.39 12.88 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.001 0.429 . . . . 70.439999999999998 111.577 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -69.6 -28.21 65.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 120.999 0.428 . . . . 62.119999999999997 111.828 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.73 -36.99 59.78 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.07 0.548 . . . . 74.219999999999999 111.805 -176.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -111.56 7.49 20.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 120.896 0.379 . . . . 75.450000000000003 111.883 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 66.24 13.38 9.14 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.36 0.664 . . . . 75.319999999999993 112.088 176.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.7 pt -88.64 178.26 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 116.55 -0.295 . . . . 74.510000000000005 111.186 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.528 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 57.0 p -107.1 156.06 19.19 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.063 0.459 . . . . 72.129999999999995 112.144 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.78 131.8 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 121.35 0.595 . . . . 71.150000000000006 111.686 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.8 p -132.05 121.76 24.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.154 -0.475 . . . . 73.019999999999996 110.072 174.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -129.49 130.06 45.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.903 0.705 . . . . 73.400000000000006 112.903 -176.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.488 ' O ' ' HB3' ' A' ' 4' ' ' ASP . 68.3 m -113.84 121.91 45.45 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.683 -0.689 . . . . 75.099999999999994 110.783 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.574 HG12 ' HG3' ' A' ' 3' ' ' MET . 25.1 mt -101.08 126.83 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.128 0.49 . . . . 72.319999999999993 112.306 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.473 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 26.0 mmm180 -75.4 100.65 4.51 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.129 -0.487 . . . . 71.219999999999999 110.917 175.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.5 tt -123.7 114.2 19.63 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.982 0.42 . . . . 74.040000000000006 109.993 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -71.79 134.11 45.96 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.442 0.534 . . . . 70.040000000000006 112.442 -177.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -71.33 89.0 0.88 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.403 -0.591 . . . . 65.200000000000003 109.403 172.564 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -75.45 1.09 14.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.254 0.835 . . . . 74.109999999999999 113.254 -166.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -123.13 91.55 3.51 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 122.137 -0.352 . . . . 70.409999999999997 110.268 171.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -59.26 -50.17 75.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.371 -0.377 . . . . 75.230000000000004 111.823 -172.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -71.26 97.98 1.66 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.054 0.454 . . . . 70.129999999999995 111.66 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 . . . . . 0 C--O 1.256 1.423 0 C-N-CA 123.374 0.67 . . . . 62.25 112.557 -177.983 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.578 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 69.3 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.836 0.351 . . . . 70.299999999999997 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.709 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 40.2 mt-10 -95.2 132.92 39.63 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 109.711 -0.477 . . . . 72.340000000000003 109.711 170.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.535 ' HE1' HD11 ' A' ' 5' ' ' ILE . 23.8 ttt -114.49 106.54 14.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.988 0.423 . . . . 70.430000000000007 110.23 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.476 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 12.5 t70 -99.67 108.44 20.8 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.197 -0.456 . . . . 38.079999999999998 111.241 -172.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.535 HD11 ' HE1' ' A' ' 3' ' ' MET . 58.6 mt -127.83 111.81 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 116.426 -0.352 . . . . 74.219999999999999 110.654 177.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -118.32 119.79 35.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.343 0.592 . . . . 75.510000000000005 112.265 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -94.17 155.53 17.01 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.802 -0.635 . . . . 73.209999999999994 111.237 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -124.13 120.02 31.13 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.888 0.375 . . . . 75.140000000000001 110.192 168.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.9 135.36 10.71 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.945 -0.645 . . . . 74.209999999999994 113.306 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.41 -43.68 59.97 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.849 0.357 . . . . 72.140000000000001 111.667 177.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -88.58 -171.48 3.35 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.067 0.46 . . . . 74.230000000000004 112.124 -178.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 54.1 tp -95.93 -52.55 4.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.545 0.572 . . . . 74.340000000000003 112.545 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -61.58 -26.75 68.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.932 0.716 . . . . 64.439999999999998 112.932 -172.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.5 -30.98 44.01 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.978 0.418 . . . . 75.230000000000004 111.026 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -59.77 -57.8 11.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.845 -0.616 . . . . 74.030000000000001 111.365 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.59 -51.16 59.48 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.131 0.419 . . . . 75.530000000000001 112.131 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 35.8 mmtp -55.27 -54.31 45.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.435 -0.348 . . . . 75.129999999999995 111.721 -176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.72 -51.99 59.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.972 0.36 . . . . 63.25 111.972 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.477 ' HB2' HD21 ' A' ' 42' ' ' LEU . 67.2 tp -55.88 -48.53 75.41 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.369 -0.378 . . . . 72.430000000000007 111.822 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -62.35 -40.84 97.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.248 0.462 . . . . 62.140000000000001 112.248 -176.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 18.6 mm-40 -60.05 -51.56 69.1 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.624 0.25 . . . . 75.049999999999997 111.174 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.4 mtp -59.38 -44.57 92.75 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.019 0.438 . . . . 74.310000000000002 111.268 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 54.0 mt -60.37 -37.15 73.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.407 -0.36 . . . . 74.230000000000004 111.219 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -57.73 -53.38 58.89 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 111.397 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -68.55 -41.61 79.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.852 0.316 . . . . 63.140000000000001 111.852 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.5 96.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.736 0.643 . . . . 74.439999999999998 112.736 -176.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 27' ' ' ARG . 28.5 mtp85 -60.04 -27.53 67.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.626 0.602 . . . . 74.209999999999994 112.626 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -58.16 -23.95 57.14 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.399 0.618 . . . . 75.239999999999995 110.965 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -114.21 -164.6 0.94 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.949 -0.569 . . . . 72.219999999999999 110.706 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.11 9.83 11.65 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.88 0.371 . . . . 53.219999999999999 111.599 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.25 86.95 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 CA-C-N 116.198 -0.456 . . . . 71.439999999999998 113.589 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 m -71.55 117.03 12.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.806 0.336 . . . . 71.530000000000001 110.963 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.457 HG22 HG12 ' A' ' 46' ' ' ILE . 56.6 t -99.19 125.23 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.38 0.511 . . . . 64.450000000000003 112.38 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.1 t -121.14 138.53 54.16 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.302 -0.408 . . . . 75.120000000000005 110.799 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.553 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.2 p90 -134.19 137.15 44.22 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.366 0.506 . . . . 75.049999999999997 112.366 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 p -124.35 138.96 54.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.198 -0.455 . . . . 72.129999999999995 111.187 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -108.08 131.6 54.43 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.045 0.45 . . . . 74.329999999999998 111.918 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -145.01 119.96 9.99 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.294 -0.412 . . . . 61.100000000000001 110.588 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 -86.72 0.07 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.105 -0.569 . . . . 73.510000000000005 112.99 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -144.92 10.77 1.36 Allowed 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.042 0.449 . . . . 71.329999999999998 111.45 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -95.32 122.78 38.38 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 111.514 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.477 HD21 ' HB2' ' A' ' 19' ' ' LEU . 33.6 tp -96.45 103.92 15.86 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.138 -0.483 . . . . 73.510000000000005 110.578 173.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.553 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.2 mt-10 -90.08 104.46 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.353 -0.385 . . . . 75.519999999999996 111.464 -177.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -105.24 109.46 27.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.73 0.3 . . . . 75.530000000000001 111.451 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.501 ' HA ' ' O ' ' A' ' 3' ' ' MET . 37.9 ttm180 -111.82 115.27 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.86 -0.525 . . . . 75.420000000000002 111.364 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.457 HG12 HG22 ' A' ' 33' ' ' VAL . 44.7 mt -92.99 137.03 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.508 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.9 m -125.51 125.2 42.88 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 111.862 0.319 . . . . 64.340000000000003 111.862 -175.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.16 58.93 1.91 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.362 -0.447 . . . . 72.5 114.143 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 18.5 m -117.16 144.63 34.1 Favored Pre-proline 0 N--CA 1.474 0.735 0 O-C-N 122.248 -0.56 . . . . 74.010000000000005 111.912 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.66 130.73 32.57 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.412 2.075 . . . . 75.140000000000001 111.626 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.18 -28.58 62.94 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.533 0.938 . . . . 72.349999999999994 113.533 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -68.1 -38.01 81.81 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 122.062 -0.399 . . . . 73.450000000000003 111.287 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -77.69 -27.23 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 121.129 0.49 . . . . 64.299999999999997 110.89 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.578 ' NH1' ' SD ' ' A' ' 1' ' ' MET . 50.3 ttp180 -49.0 -38.7 24.09 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.74 -0.664 . . . . 71.329999999999998 111.517 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -60.18 -49.09 79.01 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.166 -0.47 . . . . 74.400000000000006 111.751 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -66.98 -41.51 86.68 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.08 -0.509 . . . . 64.299999999999997 112.285 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.477 ' HB2' ' HE2' ' A' ' 3' ' ' MET . 93.1 mt -61.33 -42.96 99.54 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.864 0.364 . . . . 70.019999999999996 111.312 179.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.36 94.95 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.224 0.535 . . . . 72.439999999999998 111.138 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -67.93 -31.14 70.69 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.836 -0.62 . . . . 64.329999999999998 111.541 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.77 -33.32 70.65 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.977 0.418 . . . . 64.040000000000006 110.39 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.4 91.87 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.121 0.486 . . . . 62.119999999999997 110.925 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.95 -41.74 92.5 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.353 0.596 . . . . 73.040000000000006 110.534 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -57.16 -48.99 77.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.76 -0.654 . . . . 75.450000000000003 111.087 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.57 -40.23 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.174 -0.466 . . . . 75.430000000000007 111.392 177.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.45 -49.01 78.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.192 -0.458 . . . . 64.219999999999999 111.279 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.14 -33.82 76.92 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.938 0.399 . . . . 72.140000000000001 111.271 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.39 -55.24 29.78 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.186 -0.461 . . . . 75.109999999999999 111.489 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -93.24 2.52 56.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.272 0.471 . . . . 73.540000000000006 112.272 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m120 58.63 31.87 21.56 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.068 0.461 . . . . 74.519999999999996 111.297 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 29.2 pt -103.88 171.55 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-O 121.148 0.499 . . . . 74.230000000000004 112.004 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 97.7 m -98.49 141.37 31.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.106 -0.497 . . . . 73.310000000000002 111.301 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -147.54 142.99 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.41 -0.359 . . . . 72.450000000000003 111.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.1 p -118.71 147.88 43.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.751 0.31 . . . . 74.230000000000004 110.78 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.476 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.4 p90 -143.82 123.9 13.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.122 0.487 . . . . 73.040000000000006 111.969 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.9 m -131.81 143.61 50.32 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 116.381 -0.372 . . . . 74.150000000000006 111.4 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.31 105.66 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-O 121.197 0.522 . . . . 72.230000000000004 111.545 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.709 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 19.6 mtp180 -83.52 104.95 14.07 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.328 0.585 . . . . 72.430000000000007 111.209 178.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.552 HD23 ' HG2' ' A' ' 1' ' ' MET . 1.5 tm? -91.77 111.96 23.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.985 -0.552 . . . . 73.450000000000003 110.763 -177.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -92.41 130.4 38.1 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 120.845 0.355 . . . . 73.400000000000006 111.101 174.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.6 t60 178.97 123.45 0.05 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.686 -0.688 . . . . 74.209999999999994 110.35 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -61.27 96.31 0.05 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.193 0.521 . . . . 74.019999999999996 111.761 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -102.67 120.45 40.59 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.063 -0.517 . . . . 64.5 110.461 174.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -59.66 102.77 0.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.028 0.442 . . . . 63.219999999999999 111.344 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -69.53 137.2 52.27 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.185 -0.461 . . . . 74.120000000000005 111.507 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--O 1.254 1.317 0 CA-C-O 118.752 -0.642 . . . . 74.310000000000002 111.382 175.551 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tmm? . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 110.298 -0.26 . . . . 75.540000000000006 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.499 ' HG2' HG21 ' A' ' 47' ' ' THR . 36.3 mt-10 -135.88 140.99 44.53 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.864 0.466 . . . . 74.430000000000007 110.714 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.545 ' HE1' HD12 ' A' ' 5' ' ' ILE . 14.8 ptm -144.23 120.06 10.57 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.202 0.445 . . . . 74.5 112.202 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.618 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 29.4 m-20 -90.67 104.63 17.19 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.548 -0.296 . . . . 64.030000000000001 110.919 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.545 HD12 ' HE1' ' A' ' 3' ' ' MET . 24.3 mt -103.8 109.2 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.726 0.298 . . . . 63.539999999999999 110.936 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 4.8 ptp180 -108.47 125.61 51.97 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.256 0.55 . . . . 74.120000000000005 112.26 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -102.85 132.06 49.31 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.475 -0.784 . . . . 73.219999999999999 111.371 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -142.94 119.9 11.32 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.578 0.228 . . . . 71.209999999999994 110.665 174.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.86 160.28 30.22 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 120.826 -0.702 . . . . 74.450000000000003 113.312 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -86.3 89.05 7.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.968 0.414 . . . . 75.439999999999998 112.006 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -165.33 165.64 19.27 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.067 -0.515 . . . . 74.219999999999999 109.996 173.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -106.85 -52.16 2.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.673 0.273 . . . . 70.109999999999999 111.6 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.58 -25.6 62.26 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.313 0.486 . . . . 71.150000000000006 112.313 -178.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.53 -30.17 40.37 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.078 0.399 . . . . 72.109999999999999 112.078 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -58.96 -60.22 4.21 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.821 0.343 . . . . 71.420000000000002 111.178 174.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.74 -44.4 86.02 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 111.285 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.11 -56.13 26.03 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.081 -0.509 . . . . 73.239999999999995 112.084 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -44.33 96.13 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.119 0.485 . . . . 65.230000000000004 111.624 -177.007 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.446 ' O ' HG13 ' A' ' 23' ' ' ILE . 45.0 tp -62.09 -56.16 21.69 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.93 -0.577 . . . . 74.409999999999997 111.779 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -63.09 -41.21 99.34 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.127 0.417 . . . . 65.420000000000002 112.127 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -54.97 -47.72 74.2 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.609 0.242 . . . . 72.450000000000003 111.515 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.41 ' HE2' ' CD1' ' A' ' 5' ' ' ILE . 45.0 mtp -72.77 -36.39 67.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.667 0.27 . . . . 74.400000000000006 111.552 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 19' ' ' LEU . 63.7 mt -57.29 -34.53 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.739 0.304 . . . . 75.5 111.274 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 24' ' ' ARG . 37.1 ttp180 -48.92 -46.72 43.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.304 -0.407 . . . . 74.329999999999998 111.577 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -74.46 -43.54 55.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.633 0.254 . . . . 73.019999999999996 111.297 174.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.08 -34.57 63.74 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.639 0.607 . . . . 71.510000000000005 112.639 -177.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HE ' ' HA ' ' A' ' 27' ' ' ARG . 6.5 mmp_? -60.53 -28.98 68.83 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.759 0.314 . . . . 72.299999999999997 111.65 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.407 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.61 -13.22 60.62 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.412 0.285 . . . . 72.209999999999994 111.746 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.73 151.54 28.81 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.211 0.529 . . . . 73.030000000000001 112.043 -177.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.21 57.05 1.05 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.015 0.436 . . . . 73.230000000000004 111.233 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.52 -168.26 12.98 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.344 -0.455 . . . . 70.349999999999994 113.491 -177.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 95.8 m -103.83 127.83 51.3 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.619 -0.342 . . . . 73.439999999999998 111.751 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.7 t -131.84 110.84 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.756 0.312 . . . . 74.409999999999997 110.705 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.3 t -121.76 162.5 20.73 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.922 0.391 . . . . 64.239999999999995 111.767 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.585 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 30.3 p90 -156.41 139.44 15.42 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.236 -0.438 . . . . 73.409999999999997 111.083 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 t -137.09 133.75 35.71 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.573 0.582 . . . . 73.219999999999999 112.573 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -94.19 102.21 14.23 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.072 -0.513 . . . . 74.329999999999998 110.99 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -118.27 106.0 12.33 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.065 0.459 . . . . 73.329999999999998 111.013 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.54 -85.22 0.44 Allowed Glycine 0 CA--C 1.525 0.695 0 C-N-CA 121.208 -0.52 . . . . 55.0 112.808 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -146.14 15.39 1.33 Allowed 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.763 0.316 . . . . 74.400000000000006 111.545 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -117.66 130.28 56.26 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.47 -0.332 . . . . 71.200000000000003 110.856 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.445 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 48.8 tp -102.94 102.6 12.68 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.437 -0.347 . . . . 73.030000000000001 111.271 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.585 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 27.3 mm-40 -87.97 106.57 18.21 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.515 -0.311 . . . . 74.400000000000006 111.177 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.1 mt -111.69 110.23 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 120.557 0.218 . . . . 73.129999999999995 111.001 177.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 45' ' ' ARG . 39.3 ttt85 -107.1 122.6 46.8 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.945 -0.472 . . . . 73.420000000000002 111.721 -179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.5 mt -106.89 127.84 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 116.094 -0.503 . . . . 73.140000000000001 110.407 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.499 HG21 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -130.14 128.41 41.73 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.284 0.476 . . . . 73.129999999999995 112.284 -174.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.82 32.55 7.93 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 114.613 0.605 . . . . 45.0 114.613 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.67 141.44 24.65 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 117.506 0.653 . . . . 73.340000000000003 111.326 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.463 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 21.2 Cg_endo -59.14 133.62 54.21 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.797 2.331 . . . . 73.150000000000006 112.974 -178.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -59.58 -25.35 64.52 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.354 0.501 . . . . 71.420000000000002 112.354 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.463 ' HG2' ' HB2' ' A' ' 50' ' ' PRO . 29.0 pt20 -60.34 -34.09 73.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.76 0.314 . . . . 75.129999999999995 111.743 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.427 HG23 ' HG3' ' A' ' 52' ' ' GLN . 42.9 t -91.49 -24.42 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.001 0.429 . . . . 75.209999999999994 110.827 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.593 ' HD3' HD11 ' A' ' 76' ' ' ILE . 5.9 tmm_? -47.88 -41.82 25.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.016 0.527 . . . . 72.109999999999999 111.49 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -61.2 -42.51 98.72 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.872 0.368 . . . . 74.439999999999998 111.81 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -66.0 -45.39 81.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.883 0.373 . . . . 73.329999999999998 110.684 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.34 -43.68 83.61 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.143 0.497 . . . . 72.420000000000002 111.247 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -64.07 -46.21 85.32 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.072 -0.513 . . . . 72.239999999999995 111.719 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -71.64 -34.19 69.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.19 0.441 . . . . 73.25 112.19 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.95 -37.16 86.39 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.169 0.509 . . . . 70.030000000000001 109.988 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.512 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -63.51 -38.79 92.48 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.889 -0.596 . . . . 64.099999999999994 111.163 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 45.5 mt-10 -58.07 -40.89 82.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.858 0.361 . . . . 75.549999999999997 110.968 175.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -61.24 -44.43 97.26 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.653 -0.249 . . . . 74.450000000000003 111.032 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 61' ' ' ALA . 81.4 mt -50.46 -40.85 51.95 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.076 0.465 . . . . 75.439999999999998 111.127 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.483 ' HB2' HG12 ' A' ' 72' ' ' VAL . . . -65.8 -56.85 9.78 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.198 -0.455 . . . . 74.219999999999999 111.73 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.35 -23.92 67.11 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.19 -0.459 . . . . 72.019999999999996 112.087 -177.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -82.44 -56.23 4.01 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.1 0.476 . . . . 74.409999999999997 111.431 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -94.05 4.61 53.66 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.153 0.427 . . . . 73.510000000000005 112.153 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 61.81 20.26 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.439 0.533 . . . . 74.209999999999994 112.439 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 23.8 pt -90.17 153.13 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 116.282 -0.417 . . . . 64.400000000000006 111.366 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.5 m -87.98 122.22 31.32 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.257 -0.277 . . . . 74.230000000000004 111.252 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.483 HG12 ' HB2' ' A' ' 65' ' ' ALA . 12.5 p -123.88 133.62 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.26 0.552 . . . . 75.349999999999994 111.591 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 p -142.62 142.02 32.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.219 -0.446 . . . . 72.530000000000001 110.713 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 13.6 p90 -137.24 128.59 28.14 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.822 0.675 . . . . 73.340000000000003 112.822 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.4 m -102.78 123.86 47.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.89 -0.596 . . . . 72.230000000000004 110.197 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.593 HD11 ' HD3' ' A' ' 54' ' ' ARG . 34.3 mt -122.99 139.46 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.78 0.659 . . . . 74.439999999999998 112.78 -169.525 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.44 HH11 ' HD2' ' A' ' 77' ' ' ARG . 14.0 ptm180 -143.22 173.31 11.7 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.982 -0.554 . . . . 75.349999999999994 110.781 174.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 pp -156.84 167.39 30.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.105 0.479 . . . . 72.209999999999994 111.884 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.83 85.19 2.8 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.288 0.566 . . . . 73.120000000000005 110.775 177.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -57.9 105.74 0.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.937 -0.574 . . . . 74.540000000000006 111.223 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -53.59 113.55 1.22 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.322 0.86 . . . . 74.340000000000003 113.322 -171.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -110.23 -177.0 3.13 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.22 -0.446 . . . . 75.129999999999995 110.664 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -165.24 138.66 4.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.166 0.432 . . . . 62.340000000000003 112.166 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -78.55 144.79 35.27 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.034 -0.53 . . . . 70.019999999999996 110.654 174.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.7 m80 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.856 -0.593 . . . . 71.299999999999997 111.919 179.041 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.472 ' HE2' ' HA ' ' A' ' 51' ' ' GLU . 47.8 ttp . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.562 0.22 . . . . 74.129999999999995 110.826 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -125.8 153.51 43.95 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.245 0.461 . . . . 73.319999999999993 112.245 -175.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.453 ' HE1' HD12 ' A' ' 5' ' ' ILE . 21.1 ptm -148.29 112.14 5.11 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.951 -0.568 . . . . 75.540000000000006 110.979 175.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.562 ' HB3' ' HG2' ' A' ' 45' ' ' ARG . 2.3 p-10 -99.11 119.8 38.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.525 0.678 . . . . 74.510000000000005 111.866 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.502 HD13 ' HB1' ' A' ' 61' ' ' ALA . 56.4 mt -111.61 114.83 48.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 115.98 -0.555 . . . . 75.329999999999998 111.576 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? -101.13 112.52 25.01 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.987 0.423 . . . . 73.040000000000006 111.549 -177.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.427 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 97.8 m-85 -91.19 156.04 18.14 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.75 0.309 . . . . 75.340000000000003 111.555 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.446 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 65.1 ttt180 -139.91 121.52 15.25 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.586 -0.279 . . . . 73.25 111.206 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.25 163.82 36.73 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.164 -0.541 . . . . 53.329999999999998 113.262 178.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -87.31 -35.74 18.25 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.946 0.403 . . . . 73.340000000000003 111.525 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.7 119.68 9.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.047 -0.524 . . . . 73.439999999999998 112.036 -177.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.95 -39.86 93.57 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.076 0.465 . . . . 71.219999999999999 110.87 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.474 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 1.8 mp0 -61.9 -27.88 69.13 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.091 -0.504 . . . . 74.329999999999998 111.744 177.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.522 ' HB2' HD12 ' A' ' 70' ' ' ILE . . . -58.97 -39.65 82.38 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.828 0.347 . . . . 75.540000000000006 111.13 177.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -67.89 -53.92 22.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.33 -0.396 . . . . 75.519999999999996 111.642 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.474 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.0 pt-20 -62.38 -42.56 99.51 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.1 0.407 . . . . 64.430000000000007 112.1 -177.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.697 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 4.2 mmmp? -65.29 -42.62 92.93 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 122.296 -0.252 . . . . 75.150000000000006 111.437 178.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.505 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -62.24 -47.54 83.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.209 0.528 . . . . 72.200000000000003 111.432 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.14 -43.99 97.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.975 -0.557 . . . . 73.340000000000003 111.146 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -60.95 -48.31 82.4 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 111.593 -178.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -57.95 -53.21 60.75 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.915 0.339 . . . . 73.140000000000001 111.915 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.405 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.3 mmm -59.55 -48.6 81.03 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.774 0.321 . . . . 72.519999999999996 111.704 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.602 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.8 mt -64.64 -42.77 96.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.764 0.283 . . . . 73.0 111.764 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -51.66 -47.44 63.79 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.727 0.299 . . . . 74.140000000000001 111.666 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -72.14 -44.23 63.45 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.83 0.348 . . . . 71.409999999999997 111.315 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.57 -31.46 69.47 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.003 0.742 . . . . 74.510000000000005 113.003 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.602 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 79.5 mtp180 -58.88 -28.47 66.17 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.023 0.379 . . . . 74.150000000000006 112.023 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -70.41 -13.56 62.19 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.962 0.41 . . . . 73.109999999999999 111.391 178.366 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.13 117.72 32.01 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.454 -0.339 . . . . 74.5 110.663 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.49 87.85 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.782 0.66 . . . . 74.549999999999997 112.782 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.31 -153.8 6.23 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 112.461 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.3 m -148.09 136.0 21.02 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.758 0.313 . . . . 63.329999999999998 111.188 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.1 t -117.42 124.76 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 120.994 0.426 . . . . 75.319999999999993 111.545 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.1 t -117.79 153.54 33.27 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.389 -0.369 . . . . 74.409999999999997 110.281 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.473 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 37.6 p90 -141.8 141.93 33.18 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.61 0.596 . . . . 71.420000000000002 112.61 -173.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.487 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 17.2 m -119.18 123.36 44.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.091 -0.504 . . . . 72.25 111.14 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.46 121.54 41.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.575 0.226 . . . . 74.540000000000006 111.203 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.73 84.53 2.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.093 0.473 . . . . 71.010000000000005 111.247 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.53 -91.84 0.04 OUTLIER Glycine 0 CA--C 1.532 1.11 0 CA-C-N 116.226 -0.443 . . . . 45.149999999999999 113.56 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.446 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 17.7 m-80 -95.91 -15.04 22.66 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 122.548 -0.383 . . . . 74.329999999999998 111.609 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -97.83 149.41 22.39 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.766 0.654 . . . . 74.5 112.766 -173.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.427 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 38.0 tp -138.82 100.7 4.12 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.451 -0.795 . . . . 65.099999999999994 110.671 175.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.487 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 38.2 tt0 -89.78 104.37 16.94 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.56 -0.291 . . . . 75.230000000000004 111.387 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.75 108.72 24.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.964 0.412 . . . . 65.329999999999998 111.08 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.562 ' HG2' ' HB3' ' A' ' 4' ' ' ASP . 94.1 mtt180 -97.82 108.91 21.72 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.743 0.306 . . . . 71.430000000000007 111.384 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.6 mt -94.48 121.94 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.76 0.314 . . . . 75.450000000000003 110.803 177.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.3 m -119.06 127.97 53.91 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.859 0.318 . . . . 75.329999999999998 111.859 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.91 61.79 1.26 Allowed Glycine 0 CA--C 1.527 0.837 0 C-N-CA 121.141 -0.552 . . . . 60.009999999999998 113.929 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.81 146.52 61.69 Favored Pre-proline 0 CA--C 1.542 0.669 0 O-C-N 122.504 -0.409 . . . . 75.150000000000006 111.554 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.73 137.59 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.514 2.143 . . . . 71.340000000000003 112.446 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.472 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 36.4 tt0 -55.69 -36.73 67.47 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.879 0.696 . . . . 73.099999999999994 112.879 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.06 -30.58 68.17 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.041 0.448 . . . . 75.549999999999997 111.529 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.453 HG13 ' HG ' ' A' ' 57' ' ' LEU . 59.7 t -92.66 -32.33 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.515 -0.312 . . . . 73.549999999999997 111.281 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.51 ' HD2' HG23 ' A' ' 76' ' ' ILE . 46.4 ttp180 -47.22 -39.5 14.26 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.257 0.551 . . . . 73.209999999999994 111.338 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -52.9 -49.06 66.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.55 -0.75 . . . . 74.329999999999998 111.432 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.11 -34.87 59.48 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.114 -0.494 . . . . 74.420000000000002 111.556 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.453 ' HG ' HG13 ' A' ' 53' ' ' VAL . 93.9 mt -61.23 -33.33 73.32 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.027 0.441 . . . . 74.019999999999996 111.198 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.54 -39.08 88.4 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.017 0.437 . . . . 63.240000000000002 110.845 174.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -70.95 -29.55 65.59 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.35 -0.386 . . . . 72.530000000000001 111.638 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -54.77 -38.21 66.95 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.911 0.386 . . . . 71.209999999999994 110.523 174.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.508 ' HB2' HG21 ' A' ' 72' ' ' VAL . . . -58.22 -44.04 87.98 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.129 -0.487 . . . . 75.349999999999994 111.053 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.05 -41.46 97.38 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.244 -0.435 . . . . 75.530000000000001 111.146 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -63.21 -44.29 95.73 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.202 -0.454 . . . . 71.310000000000002 110.867 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.505 HD23 ' HA ' ' A' ' 18' ' ' ALA . 96.2 mt -63.05 -37.18 86.18 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.084 -0.507 . . . . 74.200000000000003 111.606 178.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.19 77.89 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.197 0.522 . . . . 70.299999999999997 110.703 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.84 -25.93 63.97 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.039 -0.528 . . . . 74.319999999999993 111.687 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.12 -53.1 62.08 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.125 0.488 . . . . 61.439999999999998 111.367 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -110.52 16.64 21.41 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.05 0.389 . . . . 73.239999999999995 112.05 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 60.6 23.8 13.55 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.896 0.379 . . . . 74.040000000000006 111.917 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.522 HD12 ' HB2' ' A' ' 14' ' ' ALA . 31.2 pt -91.13 179.22 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.219 0.533 . . . . 64.120000000000005 111.933 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.5 m -101.33 149.86 23.6 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.208 -0.451 . . . . 71.310000000000002 111.223 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.508 HG21 ' HB2' ' A' ' 61' ' ' ALA . 11.2 p -144.92 133.85 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.423 0.63 . . . . 74.010000000000005 112.615 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -133.07 128.56 36.48 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.766 -0.652 . . . . 65.049999999999997 110.137 173.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -128.22 153.17 47.22 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.645 0.609 . . . . 72.329999999999998 112.645 -175.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.3 m -127.49 132.69 49.94 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.846 -0.616 . . . . 44.43 110.737 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.51 HG23 ' HD2' ' A' ' 54' ' ' ARG . 39.5 mt -121.48 110.12 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.167 0.508 . . . . 72.150000000000006 111.564 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.3 ptm85 -93.93 144.46 25.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 111.35 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.42 ' H ' HD21 ' A' ' 78' ' ' LEU . 2.3 pt? -142.83 167.29 22.42 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.149 -0.478 . . . . 74.010000000000005 111.034 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.47 135.17 33.57 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.51 -0.552 . . . . 71.319999999999993 109.51 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.85 83.53 0.11 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.426 0.631 . . . . 73.120000000000005 112.268 -176.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -86.73 160.12 18.93 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.238 -0.437 . . . . 74.540000000000006 110.558 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -161.39 142.56 11.36 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.88 0.326 . . . . 74.400000000000006 111.88 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -137.17 127.84 27.01 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.742 0.306 . . . . 72.310000000000002 111.398 176.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -92.73 159.61 15.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.068 0.461 . . . . 74.040000000000006 111.423 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 41.6 m170 . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.824 -0.607 . . . . 72.209999999999994 110.56 170.688 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.405 ' HG2' ' N ' ' A' ' 2' ' ' GLU . 41.0 ttp . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.944 0.402 . . . . 74.040000000000006 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.405 ' N ' ' HG2' ' A' ' 1' ' ' MET . 29.9 mt-10 -100.04 147.0 26.09 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.196 -0.456 . . . . 55.530000000000001 110.293 173.12 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.456 ' HA ' HG12 ' A' ' 76' ' ' ILE . 21.7 ttt -148.36 108.25 4.03 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.11 0.481 . . . . 62.310000000000002 112.076 177.025 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.469 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 8.3 m-20 -92.97 110.15 21.61 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.116 -0.493 . . . . 73.439999999999998 110.627 174.034 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -115.6 116.88 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.739 -0.209 . . . . 72.519999999999996 110.78 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.442 ' O ' ' HA ' ' A' ' 72' ' ' VAL . 1.8 ptp85 -105.76 128.51 53.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.338 0.496 . . . . 62.439999999999998 112.338 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -105.06 126.04 51.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.756 -0.656 . . . . 75.319999999999993 109.665 172.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -117.03 121.95 42.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.755 0.312 . . . . 74.230000000000004 111.238 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.52 157.97 19.58 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 116.043 -0.526 . . . . 65.329999999999998 112.346 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -93.46 -10.45 34.98 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.572 0.582 . . . . 70.140000000000001 112.572 -177.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.35 109.29 2.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.163 0.506 . . . . 71.319999999999993 111.369 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.2 tp -49.19 -55.51 12.24 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.31 0.855 . . . . 62.399999999999999 113.31 -174.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.3 69.17 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.311 0.486 . . . . 65.209999999999994 112.311 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.65 67.95 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.928 0.394 . . . . 74.219999999999999 111.046 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.42 ' CD1' HD23 ' A' ' 42' ' ' LEU . 64.5 t80 -53.6 -52.05 61.07 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.896 -0.593 . . . . 62.450000000000003 111.0 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -69.38 -54.21 15.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.761 -0.654 . . . . 74.209999999999994 111.983 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -55.91 -46.74 78.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.374 0.509 . . . . 72.310000000000002 112.374 -174.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.57 -54.7 11.04 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.887 0.329 . . . . 71.430000000000007 111.887 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.6 tp -55.91 -39.27 71.38 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.848 0.356 . . . . 70.140000000000001 111.508 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.09 -39.61 95.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.56 -0.291 . . . . 75.349999999999994 111.506 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -68.81 -41.56 78.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.725 0.298 . . . . 74.540000000000006 111.313 177.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 87.7 mmm -59.99 -47.61 85.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.001 0.429 . . . . 74.430000000000007 110.949 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.48 -44.64 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-N 116.203 -0.453 . . . . 72.109999999999999 110.978 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -49.62 -50.7 41.9 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.261 0.624 . . . . 74.129999999999995 111.964 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.535 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 2.8 mp0 -70.96 -41.21 71.39 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.31 -0.405 . . . . 75.430000000000007 111.739 178.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -33.62 74.34 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.34 0.496 . . . . 53.030000000000001 112.34 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -28.86 69.54 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.03 0.382 . . . . 73.150000000000006 112.03 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.669 ' HB2' ' HZ3' ' A' ' 28' ' ' LYS . 10.4 mtmp? -70.22 -13.94 62.4 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.063 0.458 . . . . 75.129999999999995 111.147 175.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -120.28 -172.25 2.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.095 -0.502 . . . . 73.049999999999997 110.559 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -94.51 36.2 1.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.172 0.51 . . . . 72.030000000000001 110.888 174.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.12 122.71 5.84 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-N 116.232 -0.44 . . . . 73.430000000000007 113.867 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.1 m -87.71 118.0 26.92 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.571 -0.37 . . . . 73.439999999999998 110.632 175.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.2 t -105.1 137.57 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.247 0.546 . . . . 75.409999999999997 112.291 -175.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 t -152.17 167.67 27.79 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.75 -0.659 . . . . 70.140000000000001 110.297 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -156.16 158.18 37.21 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.361 0.601 . . . . 75.129999999999995 112.345 -175.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 t -132.71 133.64 43.76 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.844 -0.616 . . . . 64.540000000000006 110.846 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.23 138.39 34.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.057 0.456 . . . . 73.349999999999994 111.814 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -143.44 89.6 2.09 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.223 0.535 . . . . 70.219999999999999 110.555 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.74 -99.34 0.47 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.13 -0.486 . . . . 42.210000000000001 112.503 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -114.14 12.8 17.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 120.883 0.373 . . . . 73.409999999999997 111.243 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -104.26 130.24 52.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.815 0.341 . . . . 55.119999999999997 111.26 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.433 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 47.8 tp -120.67 96.35 5.09 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.321 -0.4 . . . . 73.209999999999994 111.279 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -87.64 109.11 19.43 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.808 0.337 . . . . 70.439999999999998 110.832 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.7 mt -101.74 115.21 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 120.83 0.348 . . . . 72.329999999999998 111.925 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.52 ' HD2' ' OG1' ' A' ' 47' ' ' THR . 0.8 OUTLIER -95.45 121.26 36.94 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.189 0.519 . . . . 73.340000000000003 111.146 175.938 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.473 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 47.1 mt -121.18 113.59 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.701 173.251 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.52 ' OG1' ' HD2' ' A' ' 45' ' ' ARG . 63.7 m -105.39 133.69 49.73 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.732 0.301 . . . . 73.219999999999999 111.365 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.84 -10.69 18.37 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.899 -0.667 . . . . 63.219999999999999 113.747 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.456 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 22.5 m -63.49 133.9 95.67 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 116.926 0.363 . . . . 74.430000000000007 111.689 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 14.3 Cg_exo -69.34 147.64 66.04 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.757 2.305 . . . . 73.319999999999993 113.616 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -46.68 -52.7 13.24 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.814 -0.63 . . . . 64.439999999999998 112.46 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -58.94 -29.88 67.45 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.487 0.551 . . . . 74.129999999999995 112.487 -177.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.533 HG12 ' HG ' ' A' ' 57' ' ' LEU . 42.6 t -79.29 -16.13 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 120.789 0.328 . . . . 74.319999999999993 111.652 -176.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.622 ' NH1' ' HB1' ' A' ' 58' ' ' ALA . 46.0 tpt85 -46.63 -37.87 8.82 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.104 0.562 . . . . 75.349999999999994 111.917 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -65.91 -54.86 21.04 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.472 -0.785 . . . . 74.5 111.94 -177.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -64.28 -37.18 86.59 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.959 0.355 . . . . 73.340000000000003 111.959 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HG ' HG12 ' A' ' 53' ' ' VAL . 95.9 mt -60.34 -45.09 94.69 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.865 0.364 . . . . 65.109999999999999 111.458 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.622 ' HB1' ' NH1' ' A' ' 54' ' ' ARG . . . -63.78 -45.65 88.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.103 0.478 . . . . 73.409999999999997 111.462 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -64.29 -31.76 73.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.035 -0.53 . . . . 74.409999999999997 111.316 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -72.69 -48.53 38.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.309 -0.405 . . . . 53.439999999999998 111.017 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.73 -42.32 71.43 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.22 0.452 . . . . 72.150000000000006 112.22 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.23 -48.7 78.14 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.734 0.302 . . . . 72.140000000000001 111.47 176.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -63.13 -37.07 85.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.272 -0.422 . . . . 73.400000000000006 110.823 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.66 -43.6 96.25 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.99 0.424 . . . . 72.209999999999994 111.612 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.06 14.43 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.18 0.437 . . . . 70.010000000000005 112.18 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -62.47 -30.7 71.44 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.033 0.382 . . . . 73.099999999999994 112.033 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -53.56 -39.5 64.82 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.837 0.351 . . . . 73.129999999999995 111.229 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -112.24 12.65 20.37 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 111.855 0.317 . . . . 73.219999999999999 111.855 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.3 t30 59.75 23.86 12.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.241 0.543 . . . . 60.210000000000001 111.898 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 32.1 pt -93.5 170.16 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.829 -0.544 . . . . 75.510000000000005 111.45 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.7 m -94.84 148.26 22.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 116.531 -0.304 . . . . 75.329999999999998 111.713 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.442 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 13.6 p -146.72 133.25 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 120.996 0.427 . . . . 75.409999999999997 111.997 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.6 p -132.67 167.6 19.79 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 122.161 -0.337 . . . . 64.430000000000007 110.988 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -125.35 146.23 49.67 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.948 0.404 . . . . 72.019999999999996 111.908 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.469 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 99.0 m -140.22 122.82 16.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.269 -0.423 . . . . 74.510000000000005 110.654 174.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.456 HG12 ' HA ' ' A' ' 3' ' ' MET . 66.0 mt -134.2 132.12 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 112.031 0.382 . . . . 72.349999999999994 112.031 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.3 mtm180 -83.57 94.51 8.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.839 -0.43 . . . . 75.129999999999995 109.839 172.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -109.75 117.7 34.58 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.046 0.45 . . . . 73.230000000000004 111.422 -171.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -93.67 130.03 39.76 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.183 -0.462 . . . . 72.400000000000006 110.739 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -134.33 134.22 41.56 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.063 0.459 . . . . 65.310000000000002 111.334 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -73.44 138.02 44.92 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.149 -0.478 . . . . 72.420000000000002 111.593 -176.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -69.98 86.12 0.53 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.554 0.693 . . . . 73.540000000000006 110.403 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -75.12 77.77 2.27 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.276 -0.875 . . . . 72.030000000000001 112.724 -172.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -171.0 24.36 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.56 -0.745 . . . . 73.129999999999995 110.538 173.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.4 m80 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.592 -0.718 . . . . 72.329999999999998 111.661 -179.835 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.946 0.403 . . . . 72.319999999999993 110.711 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.529 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 2.3 tm-20 -137.49 130.99 31.19 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.926 -0.398 . . . . 74.409999999999997 109.926 -175.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.529 ' SD ' HG13 ' A' ' 76' ' ' ILE . 12.8 tpt -115.89 120.3 38.77 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.955 1.095 . . . . 74.409999999999997 113.955 -161.388 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -97.87 120.67 38.67 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 116.471 -0.331 . . . . 72.109999999999999 110.777 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 62.7 mt -127.07 140.04 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-O 120.822 0.344 . . . . 73.299999999999997 111.028 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.412 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 67.0 mtt85 -137.89 121.7 17.6 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.951 -0.468 . . . . 74.099999999999994 112.001 -178.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -100.33 144.9 28.79 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.94 0.4 . . . . 64.420000000000002 111.61 178.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.435 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 43.7 ttm180 -143.06 131.48 22.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.388 -0.369 . . . . 65.420000000000002 110.613 174.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 168.53 -145.94 9.98 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 119.845 -1.169 . . . . 73.209999999999994 114.355 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 28.3 t70 -139.36 174.14 10.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 122.528 0.331 . . . . 72.200000000000003 111.138 -175.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.423 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 26.8 t70 84.89 137.11 0.05 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 74.129999999999995 112.103 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.8 -49.07 61.63 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.013 -0.54 . . . . 73.319999999999993 111.743 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.554 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 44.8 mt-10 -59.95 -34.35 73.14 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.609 0.242 . . . . 73.310000000000002 111.227 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.75 -44.4 69.93 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.933 0.397 . . . . 72.430000000000007 110.734 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.78 -60.28 3.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.213 -0.449 . . . . 74.530000000000001 111.912 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.554 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 9.3 pt-20 -65.36 -41.86 93.4 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.647 0.61 . . . . 75.409999999999997 112.647 -172.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -71.69 -46.58 58.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.219 -0.301 . . . . 73.430000000000007 111.6 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.468 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -61.17 -48.93 79.28 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.86 0.362 . . . . 73.450000000000003 111.027 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.435 ' O ' HG13 ' A' ' 23' ' ' ILE . 59.6 tp -58.33 -44.14 88.53 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.436 -0.347 . . . . 64.450000000000003 110.908 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.05 -47.75 80.19 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.476 -0.329 . . . . 72.239999999999995 111.68 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 21.9 mm-40 -58.94 -38.7 79.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.821 0.343 . . . . 54.43 111.592 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.468 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 86.9 mmm -67.64 -37.94 83.13 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.675 0.274 . . . . 74.019999999999996 111.036 176.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 19' ' ' LEU . 76.4 mt -64.7 -40.16 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.1 0.476 . . . . 73.519999999999996 110.569 174.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -57.57 -41.7 81.61 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.204 0.526 . . . . 74.099999999999994 110.663 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 21' ' ' GLU . 68.2 mt-30 -66.06 -45.16 82.31 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.149 -0.478 . . . . 75.420000000000002 110.636 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.97 -34.42 65.71 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.763 -0.653 . . . . 65.049999999999997 112.701 -178.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 10.3 mmm180 -63.13 -29.21 70.62 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.834 0.349 . . . . 71.25 111.422 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.4 ' HB3' ' HE3' ' A' ' 28' ' ' LYS . 26.4 mmmt -79.81 -18.33 51.18 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.058 0.392 . . . . 62.450000000000003 112.058 178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -94.38 125.42 39.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.964 0.411 . . . . 71.319999999999993 111.704 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.06 59.17 2.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.181 0.515 . . . . 73.209999999999994 111.223 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.78 -136.88 2.59 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 115.99 -0.55 . . . . 62.25 113.05 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.1 m -142.68 139.21 31.08 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.919 0.34 . . . . 74.319999999999993 111.919 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.537 HG22 HG22 ' A' ' 46' ' ' ILE . 98.3 t -121.65 137.1 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 121.013 0.435 . . . . 71.400000000000006 111.608 178.272 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.3 p -117.58 150.84 38.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.052 -0.522 . . . . 72.340000000000003 111.003 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.643 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.9 p90 -155.88 131.95 9.99 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.203 0.525 . . . . 72.209999999999994 112.383 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 t -137.29 139.62 41.03 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.16 -0.473 . . . . 74.129999999999995 111.465 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.1 140.67 29.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.904 0.383 . . . . 64.230000000000004 111.788 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -141.81 86.95 2.02 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.157 0.503 . . . . 73.239999999999995 110.6 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.98 -94.93 0.15 Allowed Glycine 0 CA--C 1.524 0.649 0 CA-C-N 116.19 -0.459 . . . . 71.409999999999997 112.972 -178.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -107.68 -7.34 16.45 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.754 0.312 . . . . 74.109999999999999 111.116 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -93.71 150.92 20.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.244 0.545 . . . . 71.409999999999997 111.812 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.43 ' HG ' HG13 ' A' ' 44' ' ' ILE . 29.8 tp -138.39 102.21 4.57 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.846 -0.616 . . . . 71.25 110.898 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.643 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 36.3 mm-40 -78.18 111.23 13.9 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.027 -0.533 . . . . 63.509999999999998 111.026 178.712 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.43 HG13 ' HG ' ' A' ' 42' ' ' LEU . 62.8 mt -122.03 109.79 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.053 0.454 . . . . 74.420000000000002 111.24 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -112.71 127.16 56.05 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.993 0.425 . . . . 72.5 110.995 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.537 HG22 HG22 ' A' ' 33' ' ' VAL . 54.7 mt -111.34 109.77 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.092 0.473 . . . . 74.530000000000001 111.047 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.529 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 89.4 m -98.68 109.26 22.04 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.083 -0.508 . . . . 72.549999999999997 111.546 -177.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.69 67.23 0.57 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 121.404 -0.427 . . . . 71.120000000000005 113.312 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 m -122.13 143.2 38.44 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 112.069 0.396 . . . . 73.409999999999997 112.069 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.35 146.25 44.78 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.752 2.302 . . . . 74.140000000000001 112.597 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -54.89 -46.92 74.85 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.916 0.389 . . . . 61.130000000000003 111.967 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.07 -22.06 60.16 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.463 0.542 . . . . 74.510000000000005 112.463 -177.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.466 HG12 ' HG ' ' A' ' 57' ' ' LEU . 48.6 t -85.92 -6.45 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-O 121.085 0.469 . . . . 74.530000000000001 111.488 -178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.404 ' HD3' HD13 ' A' ' 76' ' ' ILE . 47.6 tpt85 -50.28 -44.42 53.83 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 111.984 0.365 . . . . 70.530000000000001 111.984 176.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -63.5 -40.72 97.82 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.494 -0.321 . . . . 73.310000000000002 111.326 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.24 -51.89 61.39 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.358 -0.383 . . . . 73.129999999999995 111.169 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.3 mt -53.16 -49.37 66.78 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.876 0.37 . . . . 74.299999999999997 111.811 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.75 -51.12 52.83 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.999 0.428 . . . . 61.43 111.822 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -58.43 -42.63 87.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.955 -0.566 . . . . 72.420000000000002 112.257 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.602 ' HG3' HH21 ' A' ' 63' ' ' ARG . 0.4 OUTLIER -70.43 -43.29 70.25 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.235 -0.439 . . . . 75.510000000000005 111.783 178.865 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.88 82.69 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.042 0.449 . . . . 74.420000000000002 111.314 176.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 45.1 mt-10 -61.66 -43.64 98.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.265 -0.425 . . . . 65.230000000000004 111.112 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.602 HH21 ' HG3' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -55.97 -44.16 78.25 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.883 0.373 . . . . 72.230000000000004 111.227 176.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.452 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 96.2 mt -60.32 -48.87 79.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.0 0.429 . . . . 73.329999999999998 111.09 176.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.59 -52.33 65.87 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.151 -0.477 . . . . 72.099999999999994 112.023 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.701 ' HZ1' ' HB3' ' A' ' 66' ' ' LYS . 7.7 mtpm? -61.63 -44.67 96.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.28 -0.418 . . . . 75.099999999999994 112.033 -177.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.0 -34.2 73.01 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 120.83 0.348 . . . . 60.530000000000001 111.898 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.1 7.76 36.37 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.259 0.466 . . . . 73.409999999999997 112.259 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 58.68 30.98 20.65 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.468 0.544 . . . . 74.019999999999996 112.468 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.6 pt -109.6 177.13 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.009 0.433 . . . . 73.329999999999998 111.728 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.435 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 55.4 p -102.62 153.4 20.14 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.119 0.485 . . . . 72.019999999999996 111.921 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -152.11 141.56 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.128 0.489 . . . . 74.439999999999998 111.628 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.412 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 74.4 p -118.55 141.21 48.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.253 -0.43 . . . . 63.530000000000001 110.079 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.6 p90 -140.86 120.06 12.93 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.55 -0.296 . . . . 71.430000000000007 111.002 -176.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.0 m -153.58 116.71 4.56 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.446 0.535 . . . . 74.319999999999993 112.446 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.529 HG13 ' SD ' ' A' ' 3' ' ' MET . 29.1 mt -76.96 141.76 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.491 -0.322 . . . . 73.129999999999995 110.408 171.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.03 94.26 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.066 0.936 . . . . 71.230000000000004 110.999 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.98 146.94 52.02 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.453 -0.794 . . . . 73.420000000000002 112.239 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -95.29 137.12 34.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.106 -0.497 . . . . 75.329999999999998 110.956 177.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.1 m-70 -83.35 116.58 22.53 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.735 0.303 . . . . 70.420000000000002 110.384 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -68.33 -61.3 1.9 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.546 0.213 . . . . 73.430000000000007 111.272 -176.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 82.7 t60 68.64 -22.11 0.14 Allowed 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 114.299 1.222 . . . . 75.510000000000005 114.299 168.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -64.09 124.6 22.05 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.858 -0.526 . . . . 71.400000000000006 111.571 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -104.48 142.29 34.88 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.258 0.551 . . . . 71.400000000000006 112.08 -177.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 70.5 m80 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.828 -0.606 . . . . 74.140000000000001 111.015 174.712 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.505 ' HE3' ' HG3' ' A' ' 54' ' ' ARG . 44.7 ttp . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.475 0.178 . . . . 74.530000000000001 110.553 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -124.38 164.08 20.41 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.971 0.415 . . . . 62.109999999999999 111.373 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt -148.43 118.84 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.789 0.328 . . . . 74.340000000000003 111.828 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.413 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 37.0 m-20 -94.81 104.77 16.68 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.779 0.324 . . . . 65.310000000000002 111.487 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.1 mt -105.12 146.45 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 122.33 0.252 . . . . 73.420000000000002 110.518 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.475 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 5.9 ptm180 -144.16 118.25 9.47 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.509 0.671 . . . . 75.239999999999995 111.882 175.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -90.41 149.88 22.08 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.774 -0.648 . . . . 64.319999999999993 110.331 174.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -141.74 120.38 12.55 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.701 0.286 . . . . 72.329999999999998 110.431 -178.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.12 -164.83 36.21 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 121.065 -0.588 . . . . 53.130000000000003 113.143 -177.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -118.37 -24.48 6.85 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.21 0.448 . . . . 73.150000000000006 112.21 -176.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.9 118.32 6.55 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.562 . . . . 71.340000000000003 112.516 -173.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -67.59 -43.59 80.17 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.067 -0.515 . . . . 71.519999999999996 111.741 -178.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.462 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 3.5 mp0 -53.97 -30.63 47.78 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.0 0.371 . . . . 62.420000000000002 112.0 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.22 -40.36 70.75 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.488 -0.324 . . . . 74.319999999999993 111.713 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.458 ' O ' ' HB3' ' A' ' 19' ' ' LEU . 84.3 t80 -53.42 -57.23 11.37 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.306 -0.406 . . . . 72.010000000000005 111.429 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -65.38 -57.22 8.88 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.83 0.348 . . . . 74.239999999999995 111.625 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.462 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 72.8 mmtt -59.77 -47.34 86.07 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.383 0.512 . . . . 74.329999999999998 112.383 -170.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.454 ' HB3' HD11 ' A' ' 64' ' ' LEU . . . -75.0 -58.71 3.12 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.547 0.573 . . . . 73.409999999999997 112.547 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.458 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 67.7 tp -61.86 -53.29 57.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.194 0.442 . . . . 73.019999999999996 112.194 -173.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -60.56 -33.27 72.45 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.15 0.5 . . . . 74.140000000000001 110.755 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.492 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 16.1 tp10 -66.78 -44.2 81.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.33 0.652 . . . . 64.120000000000005 111.029 176.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.53 -44.61 90.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.994 0.425 . . . . 71.239999999999995 111.315 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.545 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.0 mt -61.15 -39.7 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.905 0.383 . . . . 75.549999999999997 110.782 175.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 52.3 ttt180 -49.38 -53.84 20.4 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.933 -0.576 . . . . 71.420000000000002 111.421 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.47 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 2.8 mp0 -61.04 -42.64 98.86 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.856 0.36 . . . . 74.310000000000002 111.273 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.37 -25.33 64.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.059 0.392 . . . . 74.439999999999998 112.059 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.545 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 3.9 mmp_? -77.96 -30.01 50.12 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.733 0.301 . . . . 74.430000000000007 111.529 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.47 ' HE2' ' HA ' ' A' ' 25' ' ' GLN . 54.1 mtmt -75.21 -35.84 61.45 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.015 0.436 . . . . 73.329999999999998 110.863 175.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -90.4 -173.38 3.77 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.291 -0.413 . . . . 74.510000000000005 110.851 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.38 10.73 38.86 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.058 -0.401 . . . . 65.030000000000001 111.848 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -84.33 170.36 46.7 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 121.129 -0.558 . . . . 74.510000000000005 113.457 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 85.7 m -134.22 136.22 43.53 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.428 -0.454 . . . . 75.439999999999998 111.3 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.457 HG22 HG12 ' A' ' 46' ' ' ILE . 95.4 t -109.92 123.92 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.0 0.429 . . . . 73.230000000000004 111.973 -178.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 t -117.15 158.93 23.4 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.442 -0.345 . . . . 74.310000000000002 110.664 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -155.07 143.8 20.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.928 0.394 . . . . 63.299999999999997 112.035 -174.214 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -126.6 129.94 49.53 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.001 0.429 . . . . 73.510000000000005 111.419 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.429 HD23 ' HE1' ' A' ' 15' ' ' PHE . 4.0 mm? -89.68 133.62 34.56 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 111.069 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.442 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 12.1 t70 -138.3 81.02 1.83 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.349 -0.387 . . . . 72.400000000000006 110.488 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.51 -85.79 0.03 OUTLIER Glycine 0 CA--C 1.532 1.103 0 C-N-CA 121.428 -0.415 . . . . 72.140000000000001 113.634 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -117.0 9.43 13.68 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.989 0.423 . . . . 72.129999999999995 111.504 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.442 ' HB2' ' HB3' ' A' ' 38' ' ' ASP . 5.8 m-20 -112.66 128.75 56.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.295 -0.411 . . . . 74.310000000000002 111.553 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.46 95.61 5.04 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.112 0.482 . . . . 75.299999999999997 110.331 174.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.475 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 32.4 mt-10 -93.5 112.15 23.98 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.261 0.553 . . . . 75.209999999999994 111.576 -176.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.9 mt -109.38 111.73 37.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-N 115.752 -0.658 . . . . 72.510000000000005 111.988 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.468 HH12 ' HD2' ' A' ' 77' ' ' ARG . 51.4 ttt85 -101.85 128.18 48.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.903 0.383 . . . . 74.349999999999994 111.315 178.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.457 HG12 HG22 ' A' ' 33' ' ' VAL . 49.3 mt -111.29 130.73 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 121.128 0.489 . . . . 74.25 111.586 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.7 m -121.08 141.01 51.19 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.246 -0.434 . . . . 75.430000000000007 111.533 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.23 46.16 5.09 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 121.247 -0.501 . . . . 51.140000000000001 113.59 177.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.8 m -125.31 139.23 33.34 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.539 -0.389 . . . . 71.420000000000002 111.539 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.42 168.86 16.13 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.807 2.338 . . . . 73.349999999999994 113.033 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.52 -48.63 74.36 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.57 0.581 . . . . 71.299999999999997 112.57 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.43 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.8 pt20 -59.72 -42.45 93.14 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.386 0.513 . . . . 71.25 112.386 -176.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.43 HG23 ' HG3' ' A' ' 52' ' ' GLN . 90.0 t -76.97 -30.91 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 120.686 0.279 . . . . 74.349999999999994 111.496 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.505 ' HG3' ' HE3' ' A' ' 1' ' ' MET . 4.1 tmm_? -55.85 -46.0 78.3 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.663 0.268 . . . . 75.319999999999993 110.576 178.236 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -57.16 -43.25 82.37 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.018 0.437 . . . . 71.209999999999994 111.304 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.02 -40.55 96.59 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 111.293 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.91 -41.73 97.6 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.402 -0.363 . . . . 62.439999999999998 111.171 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.29 88.41 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.123 0.487 . . . . 71.420000000000002 111.217 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -55.61 -38.2 69.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.707 -0.679 . . . . 73.319999999999993 111.029 177.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.492 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 8.9 tp10 -70.35 -52.22 24.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.02 -0.536 . . . . 74.530000000000001 110.841 176.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.467 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -52.35 -51.44 58.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.765 0.654 . . . . 72.439999999999998 112.765 -176.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.47 -37.09 72.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.958 0.408 . . . . 75.430000000000007 111.416 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -39.28 68.98 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.344 -0.389 . . . . 62.130000000000003 111.394 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.492 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 94.4 mt -56.84 -45.51 82.32 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.999 0.428 . . . . 73.340000000000003 111.184 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.422 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -64.2 -50.71 67.02 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.148 -0.478 . . . . 75.019999999999996 111.478 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.601 ' HZ2' ' HB3' ' A' ' 66' ' ' LYS . 3.3 mmmp? -52.14 -44.3 64.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.119 -0.492 . . . . 74.239999999999995 112.193 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.15 -24.41 67.15 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.123 0.416 . . . . 75.209999999999994 112.123 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -114.86 10.75 16.5 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.761 0.315 . . . . 75.450000000000003 111.757 176.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m120 62.03 16.06 7.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.992 0.738 . . . . 75.439999999999998 112.992 177.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.422 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 30.4 pt -92.27 165.71 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-O 121.107 0.48 . . . . 74.510000000000005 111.953 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.4 m -89.57 148.4 23.39 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.342 -0.39 . . . . 75.439999999999998 111.338 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.26 134.49 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.099 0.476 . . . . 75.420000000000002 111.745 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.2 p -131.6 155.75 46.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.164 -0.471 . . . . 74.519999999999996 110.066 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.413 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -146.07 128.87 16.29 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.45 0.643 . . . . 74.230000000000004 112.624 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.3 m -100.55 136.13 40.91 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.732 -0.667 . . . . 73.540000000000006 110.615 176.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.2 mm -102.21 135.62 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.644 0.259 . . . . 72.049999999999997 111.307 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.468 ' HD2' HH12 ' A' ' 45' ' ' ARG . 7.9 ptp180 -139.71 134.25 31.67 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.304 0.573 . . . . 75.510000000000005 111.555 175.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.729 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.3 pt? -104.4 166.14 10.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.822 -0.626 . . . . 75.340000000000003 110.482 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.74 118.26 9.34 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.121 0.486 . . . . 75.120000000000005 110.346 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -71.46 90.87 1.0 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.44 0.638 . . . . 75.209999999999994 111.98 -177.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -114.93 117.54 30.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.999 -0.546 . . . . 72.510000000000005 111.226 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 61.17 -96.64 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.916 0.487 . . . . 55.420000000000002 112.177 -176.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.0 t60 49.51 95.89 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.659 0.614 . . . . 55.009999999999998 112.659 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -136.08 150.48 49.15 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.273 0.558 . . . . 72.340000000000003 112.151 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 85.0 t60 . . . . . 0 C--O 1.255 1.345 0 CA-C-N 115.498 -0.773 . . . . 70.310000000000002 111.188 176.482 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttp . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.905 0.383 . . . . 73.530000000000001 111.427 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.475 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 35.7 mt-10 -84.86 169.55 14.01 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.646 0.26 . . . . 64.25 110.747 174.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.513 ' HE2' HD11 ' A' ' 5' ' ' ILE . 23.9 ttt -127.41 107.23 9.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.693 0.282 . . . . 74.510000000000005 111.585 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.533 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 5.1 m-20 -93.38 128.28 39.36 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.078 -0.51 . . . . 60.32 111.268 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.513 HD11 ' HE2' ' A' ' 3' ' ' MET . 52.6 mt -136.57 146.29 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.403 0.281 . . . . 73.150000000000006 111.054 179.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.433 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 98.3 mtt180 -131.69 110.4 10.87 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 122.081 -0.387 . . . . 75.540000000000006 111.676 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -89.75 131.93 35.46 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.085 -0.507 . . . . 75.530000000000001 110.999 176.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -135.34 129.13 32.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.351 -0.218 . . . . 75.109999999999999 110.552 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.85 -158.22 9.56 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 120.462 -0.875 . . . . 63.130000000000003 114.394 -176.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.28 13.94 19.21 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.761 0.652 . . . . 53.100000000000001 112.761 -175.465 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -143.9 150.28 38.17 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.24 0.543 . . . . 72.310000000000002 112.395 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.0 tp -77.02 -57.83 3.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.583 -0.735 . . . . 74.310000000000002 111.579 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.577 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 33.1 mt-10 -62.9 -27.14 69.16 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.122 0.416 . . . . 71.129999999999995 112.122 -176.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.7 68.74 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.874 0.369 . . . . 64.329999999999998 110.942 174.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.404 ' HB3' HD21 ' A' ' 42' ' ' LEU . 25.1 m-85 -64.02 -41.55 97.41 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.115 0.483 . . . . 72.230000000000004 110.821 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.69 -33.16 74.35 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.81 -0.632 . . . . 70.310000000000002 111.497 -177.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 11.0 mmpt? -64.37 -52.77 56.62 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.214 0.53 . . . . 75.420000000000002 110.246 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.478 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -58.8 -46.73 86.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.832 -0.622 . . . . 73.329999999999998 111.188 177.472 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -55.52 -47.21 76.61 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.844 -0.616 . . . . 75.239999999999995 111.436 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -60.53 -43.85 96.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.233 -0.439 . . . . 72.420000000000002 111.488 -177.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.56 -42.74 98.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.438 -0.346 . . . . 73.430000000000007 111.659 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.427 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 94.8 mmm -62.32 -44.37 96.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.673 -0.239 . . . . 75.299999999999997 111.364 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.412 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 74.8 mt -64.53 -45.84 94.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 120.784 0.326 . . . . 74.209999999999994 111.089 176.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.9 ttp85 -54.29 -43.97 71.53 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.111 0.481 . . . . 74.120000000000005 111.332 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -74.07 -39.84 63.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.163 -0.472 . . . . 74.430000000000007 111.739 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . 0.444 ' HA ' ' HD2' ' A' ' 29' ' ' PHE . . . -59.76 -29.69 68.34 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.342 0.497 . . . . 70.409999999999997 112.342 -177.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.8 mtp180 -56.81 -28.38 61.4 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.11 0.411 . . . . 74.340000000000003 112.11 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.2 -26.98 67.64 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 111.958 0.355 . . . . 75.120000000000005 111.958 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.444 ' HD2' ' HA ' ' A' ' 26' ' ' ALA . 44.9 m-85 -92.77 142.91 26.82 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 75.040000000000006 111.646 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.67 77.5 6.28 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.159 0.504 . . . . 64.340000000000003 110.941 176.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -154.47 -155.99 7.5 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 120.886 -0.673 . . . . 61.219999999999999 113.934 -177.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -128.57 139.72 52.15 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 122.648 -0.325 . . . . 71.430000000000007 111.408 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -114.61 130.29 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.794 0.331 . . . . 75.319999999999993 111.303 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 t -145.29 154.24 42.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.798 0.332 . . . . 63.43 111.679 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -156.38 161.79 40.1 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.108 0.48 . . . . 74.510000000000005 112.162 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.7 t -137.36 141.89 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 110.765 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.9 tp -121.39 128.33 52.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.949 0.404 . . . . 75.530000000000001 111.832 -176.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -127.63 84.67 2.27 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.144 0.497 . . . . 64.120000000000005 110.386 173.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.04 -101.0 0.38 Allowed Glycine 0 CA--C 1.528 0.868 0 CA-C-N 115.66 -0.7 . . . . 64.019999999999996 114.258 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -94.89 11.46 31.64 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.786 0.662 . . . . 73.239999999999995 112.786 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -145.04 133.38 21.75 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.968 0.413 . . . . 72.329999999999998 111.522 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD21 ' HB3' ' A' ' 15' ' ' PHE . 65.5 tp -122.35 117.39 25.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.399 . . . . 74.450000000000003 111.902 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -94.6 118.6 31.95 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.863 0.363 . . . . 71.409999999999997 111.253 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 46.5 mt -118.59 126.68 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.735 0.414 . . . . 75.439999999999998 110.761 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 3' ' ' MET . 39.9 ttp180 -125.15 121.09 33.19 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.952 0.405 . . . . 74.510000000000005 111.566 177.162 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.43 119.56 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.114 0.483 . . . . 73.510000000000005 110.843 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.475 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 59.2 m -92.35 112.49 24.46 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.946 -0.57 . . . . 74.010000000000005 111.913 -176.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.5 68.96 0.86 Allowed Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.241 -0.504 . . . . 62.210000000000001 113.571 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -126.3 130.32 23.96 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 120.799 0.333 . . . . 72.430000000000007 111.477 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.49 155.41 31.96 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.041 2.494 . . . . 74.010000000000005 114.153 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -66.67 -41.68 87.77 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.823 -0.626 . . . . 71.25 112.437 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.478 ' HG3' HG23 ' A' ' 53' ' ' VAL . 11.4 pt20 -59.23 -26.63 65.04 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.132 0.419 . . . . 70.129999999999995 112.132 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.478 HG23 ' HG3' ' A' ' 52' ' ' GLN . 38.3 t -98.4 -5.38 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-O 120.992 0.425 . . . . 72.430000000000007 111.642 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.506 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 18.1 tpp180 -53.07 -40.7 64.23 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 122.214 -0.303 . . . . 71.120000000000005 111.048 178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -50.93 -50.78 57.03 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.179 0.514 . . . . 73.239999999999995 111.5 177.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -66.73 -54.26 24.7 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.657 -0.701 . . . . 72.430000000000007 111.486 -176.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.97 -46.97 81.82 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.052 -0.522 . . . . 71.519999999999996 111.905 -178.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.93 76.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.876 0.369 . . . . 65.230000000000004 111.606 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -76.19 -36.42 58.65 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.908 0.385 . . . . 73.109999999999999 111.323 -179.189 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -63.65 -45.37 90.5 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.921 0.391 . . . . 73.430000000000007 111.294 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.505 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -60.38 -35.3 75.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.385 -0.37 . . . . 54.329999999999998 111.575 177.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.48 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 23.0 mm-40 -55.23 -49.29 72.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.845 0.355 . . . . 63.049999999999997 110.15 172.144 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.501 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 20.9 ttm-85 -56.06 -53.22 59.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.11 -0.495 . . . . 74.120000000000005 110.594 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 61' ' ' ALA . 88.5 mt -48.8 -46.85 42.3 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.714 -0.675 . . . . 74.519999999999996 112.18 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.18 88.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.31 -0.405 . . . . 73.510000000000005 111.781 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.48 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 32.2 mmtp -72.36 -35.12 68.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.506 0.558 . . . . 72.430000000000007 112.506 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 13.6 mm-40 -54.27 -41.42 68.83 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.051 0.453 . . . . 74.209999999999994 111.353 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -103.37 1.43 32.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.335 -0.393 . . . . 71.099999999999994 111.498 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.1 m120 54.24 42.32 31.56 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.488 0.661 . . . . 74.540000000000006 111.591 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 35.3 pt -103.74 169.3 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.589 -0.732 . . . . 73.0 111.308 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.6 m -87.71 148.97 24.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.64 0.257 . . . . 72.239999999999995 111.645 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.27 136.17 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.105 0.479 . . . . 73.409999999999997 112.051 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.433 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 73.6 p -118.22 146.47 44.22 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.429 -0.351 . . . . 72.200000000000003 111.179 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -122.93 137.65 54.89 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.117 0.484 . . . . 75.420000000000002 112.225 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.533 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 97.6 m -136.34 105.44 5.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.012 -0.54 . . . . 72.349999999999994 109.972 173.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.7 mm -101.29 105.48 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 122.26 -0.275 . . . . 74.510000000000005 110.987 -178.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.412 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 18.3 ptp180 -81.2 100.71 9.25 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.629 0.728 . . . . 71.040000000000006 111.249 -178.591 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.1 tt -92.78 126.66 37.97 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.036 -0.529 . . . . 73.530000000000001 109.763 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.23 104.36 1.17 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.101 0.477 . . . . 74.329999999999998 112.022 -176.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -126.75 110.35 13.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.029 -0.532 . . . . 72.409999999999997 110.599 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -140.0 140.45 36.26 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.917 0.389 . . . . 72.409999999999997 111.614 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -69.59 -48.11 61.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.263 0.468 . . . . 74.239999999999995 112.263 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.9 t-80 64.34 105.49 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.019 0.438 . . . . 70.109999999999999 111.935 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -110.3 154.65 23.17 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.497 -0.32 . . . . 64.450000000000003 111.154 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 8.2 p80 . . . . . 0 C--O 1.254 1.294 0 CA-C-O 119.491 -0.29 . . . . 71.230000000000004 111.429 175.18 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.816 ' SD ' HD12 ' A' ' 78' ' ' LEU . 47.3 ttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.658 0.266 . . . . 74.25 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -117.27 155.74 28.96 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.01 0.374 . . . . 72.409999999999997 112.01 -172.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.625 ' HB3' ' NH1' ' A' ' 54' ' ' ARG . 21.8 ptm -149.59 142.36 24.64 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.338 0.495 . . . . 75.040000000000006 112.338 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -112.67 118.36 34.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 122.602 0.361 . . . . 72.25 111.518 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.488 HD12 ' HE3' ' A' ' 3' ' ' MET . 59.1 mt -115.96 114.54 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 120.612 0.244 . . . . 71.010000000000005 110.862 175.842 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.451 ' HD2' ' N ' ' A' ' 6' ' ' ARG . 3.5 mpt_? -109.02 121.59 45.46 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.938 0.399 . . . . 75.040000000000006 111.809 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.549 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 88.4 m-85 -94.34 150.18 20.53 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.258 -0.428 . . . . 73.540000000000006 110.922 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.484 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 17.2 tpt180 -142.39 120.42 12.1 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.276 -0.42 . . . . 73.120000000000005 110.878 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.513 ' HA3' HG23 ' A' ' 70' ' ' ILE . . . -178.59 -179.35 48.41 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.978 -0.63 . . . . 71.129999999999995 113.108 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -108.49 -17.47 13.97 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.517 0.562 . . . . 61.329999999999998 112.517 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.38 110.18 7.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.027 0.441 . . . . 71.010000000000005 110.898 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 50.6 tp -62.38 -41.73 98.86 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.232 0.456 . . . . 65.310000000000002 112.232 -175.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -66.37 -35.03 79.31 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.577 0.227 . . . . 74.5 111.51 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.6 70.86 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.464 -0.334 . . . . 73.230000000000004 111.691 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -56.18 -51.77 66.82 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.651 -0.249 . . . . 74.329999999999998 111.403 177.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.26 -45.24 85.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.736 0.303 . . . . 71.450000000000003 111.439 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -57.83 -38.77 76.19 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.805 0.336 . . . . 75.099999999999994 111.804 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.534 ' HA ' HD21 ' A' ' 64' ' ' LEU . . . -73.96 -53.14 10.75 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.407 0.623 . . . . 73.239999999999995 111.234 177.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -60.07 -46.1 90.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.628 -0.715 . . . . 65.140000000000001 112.525 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -58.6 -40.0 81.99 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.776 0.43 . . . . 75.319999999999993 111.646 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -73.58 -38.83 65.04 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.889 0.376 . . . . 75.030000000000001 111.198 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 97.1 mmm -58.27 -46.58 85.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.066 0.46 . . . . 74.25 110.452 174.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 69.0 mt -64.63 -39.36 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.048 -0.524 . . . . 74.530000000000001 111.004 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 8.9 tpt180 -53.62 -50.11 66.39 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.855 0.36 . . . . 74.150000000000006 111.044 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -67.1 -48.78 67.12 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.397 -0.365 . . . . 72.400000000000006 111.13 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.84 -34.08 67.42 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.685 0.624 . . . . 71.129999999999995 112.685 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -59.21 -27.74 66.0 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.024 0.379 . . . . 75.409999999999997 112.024 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -76.62 -18.26 58.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.816 0.341 . . . . 74.129999999999995 111.875 178.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -108.33 143.79 36.74 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.079 0.466 . . . . 74.400000000000006 111.679 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.3 89.6 5.52 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.077 0.465 . . . . 75.109999999999999 111.759 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -155.97 -155.53 7.42 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.246 -0.502 . . . . 73.120000000000005 112.975 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.3 m -137.73 131.29 31.1 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.519 -0.401 . . . . 63.119999999999997 111.258 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.417 HG23 HG22 ' A' ' 46' ' ' ILE . 88.8 t -124.81 118.62 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.844 0.355 . . . . 74.340000000000003 111.264 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.436 ' OG1' ' HB3' ' A' ' 45' ' ' ARG . 30.3 p -107.41 129.76 54.89 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.531 -0.304 . . . . 71.219999999999999 111.007 179.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 52.7 p90 -133.0 142.74 49.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.349 0.5 . . . . 64.120000000000005 112.349 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 64.8 p -133.21 137.99 46.35 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.124 -0.489 . . . . 73.129999999999995 111.456 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.24 134.46 53.76 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.252 -0.431 . . . . 74.239999999999995 110.935 177.151 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -149.95 95.93 2.37 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.955 0.407 . . . . 72.129999999999995 111.396 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.66 -82.26 0.05 OUTLIER Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.263 -0.494 . . . . 75.340000000000003 113.532 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.484 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 13.0 m120 -122.47 -3.65 8.85 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 122.489 -0.419 . . . . 75.010000000000005 112.014 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -101.95 134.99 44.29 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.992 0.425 . . . . 71.400000000000006 111.822 -177.399 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 22.9 tp -128.91 99.96 5.49 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.022 -0.536 . . . . 74.25 110.366 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.423 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 46.0 mt-10 -91.92 104.48 16.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 75.409999999999997 111.326 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.6 mt -102.14 128.8 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.223 -0.444 . . . . 74.230000000000004 110.409 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' HB3' ' OG1' ' A' ' 34' ' ' THR . 51.1 ttt180 -126.16 112.57 15.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.93 0.395 . . . . 72.319999999999993 110.475 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.417 HG22 HG23 ' A' ' 33' ' ' VAL . 52.7 mt -104.85 114.47 44.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-O 121.246 0.546 . . . . 75.239999999999995 111.531 -176.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.6 m -105.14 113.82 27.65 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.848 -0.615 . . . . 64.239999999999995 111.769 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.3 -43.54 1.28 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 120.599 -0.81 . . . . 62.100000000000001 114.515 174.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.564 HG22 HH21 ' A' ' 54' ' ' ARG . 17.6 m -50.7 128.8 26.89 Favored Pre-proline 0 N--CA 1.478 0.969 0 N-CA-C 113.833 1.049 . . . . 74.239999999999995 113.833 -172.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -85.42 -169.26 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.772 2.981 . . . . 75.019999999999996 114.277 -177.059 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -48.45 -72.02 0.06 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.582 0.956 . . . . 75.239999999999995 113.582 -176.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.467 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 24.2 pt20 -50.11 -34.41 21.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.754 0.65 . . . . 64.349999999999994 112.754 -174.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 t -80.23 -36.02 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 120.989 0.423 . . . . 74.439999999999998 111.447 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.625 ' NH1' ' HB3' ' A' ' 3' ' ' MET . 4.5 tpp180 -53.77 -52.78 59.11 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.85 -0.614 . . . . 74.209999999999994 112.016 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.467 ' HE3' ' HA ' ' A' ' 52' ' ' GLN . 22.2 pttp -61.67 -34.68 76.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.091 -0.504 . . . . 75.549999999999997 111.951 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -71.53 -42.51 67.85 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.66 0.267 . . . . 74.150000000000006 111.617 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.42 HD11 HG13 ' A' ' 49' ' ' VAL . 86.6 mt -64.45 -45.35 87.84 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.945 0.402 . . . . 73.519999999999996 111.183 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.29 96.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.171 0.51 . . . . 71.299999999999997 111.203 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -63.77 -35.43 80.58 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.043 -0.526 . . . . 73.319999999999993 111.593 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -67.12 -42.56 84.3 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.915 0.388 . . . . 71.349999999999994 110.998 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.539 ' HB2' HG21 ' A' ' 72' ' ' VAL . . . -52.17 -40.84 62.02 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.082 -0.508 . . . . 72.239999999999995 112.058 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.5 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 35.0 mm-40 -61.74 -50.55 71.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.727 0.298 . . . . 72.150000000000006 111.682 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -55.45 -51.7 66.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.94 0.4 . . . . 74.409999999999997 111.101 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.534 HD21 ' HA ' ' A' ' 18' ' ' ALA . 83.4 mt -55.39 -41.28 72.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.745 -0.661 . . . . 72.230000000000004 111.465 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.513 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -64.68 -50.96 64.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.178 0.513 . . . . 45.140000000000001 112.256 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 10.5 mmpt? -63.19 -60.54 3.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.096 0.776 . . . . 65.230000000000004 113.096 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -75.44 -15.77 60.4 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.962 0.727 . . . . 72.150000000000006 112.962 -172.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . 0.444 ' HB2' ' O ' ' A' ' 64' ' ' LEU . 84.9 m-85 -100.6 8.57 43.34 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 122.079 -0.388 . . . . 74.0 111.973 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 60.46 35.75 20.28 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.584 0.587 . . . . 75.329999999999998 112.584 173.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.513 HG23 ' HA3' ' A' ' 9' ' ' GLY . 20.6 pt -126.06 149.38 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 121.184 0.516 . . . . 75.340000000000003 111.639 179.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.7 m -86.97 139.59 30.44 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.403 -0.362 . . . . 72.219999999999999 110.735 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.539 HG21 ' HB2' ' A' ' 61' ' ' ALA . 14.5 p -126.22 122.1 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.547 0.689 . . . . 73.349999999999994 112.414 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 80.9 p -121.18 121.7 38.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.788 -0.642 . . . . 73.109999999999999 110.449 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -122.05 143.09 49.71 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.869 0.692 . . . . 75.439999999999998 112.869 -175.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 94.4 m -122.54 120.26 33.29 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.567 -0.742 . . . . 75.530000000000001 110.612 178.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -118.79 144.86 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.959 0.409 . . . . 70.299999999999997 111.451 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.443 ' HD3' ' HA ' ' A' ' 77' ' ' ARG . 59.3 mmt-85 -123.68 110.47 15.01 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.023 0.44 . . . . 75.329999999999998 111.513 175.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.816 HD12 ' SD ' ' A' ' 1' ' ' MET . 33.3 tp -117.23 112.9 21.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.248 -0.433 . . . . 74.400000000000006 110.774 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -67.82 95.56 0.52 Allowed 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.232 0.539 . . . . 74.120000000000005 110.81 178.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.6 p-80 -118.2 128.42 54.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.076 -0.511 . . . . 74.25 111.3 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -79.18 142.34 36.41 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.128 -0.487 . . . . 71.049999999999997 111.428 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -63.74 113.14 3.19 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.956 0.408 . . . . 75.209999999999994 110.523 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -67.5 -38.79 84.86 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.689 0.626 . . . . 74.409999999999997 112.689 -170.795 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -123.33 163.78 20.09 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.925 0.393 . . . . 72.140000000000001 111.822 -179.114 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 . . . . . 0 C--O 1.254 1.307 0 CA-C-O 118.79 -0.624 . . . . 72.519999999999996 111.733 176.944 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.627 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 49.4 ttp . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.044 0.45 . . . . 70.109999999999999 111.51 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.637 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 27.3 mt-10 -127.42 170.8 12.15 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.115 -0.493 . . . . 73.099999999999994 110.774 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.658 ' SD ' ' NH2' ' A' ' 54' ' ' ARG . 27.5 ttt -143.69 128.0 17.78 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.649 0.611 . . . . 73.140000000000001 112.649 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.502 ' HB3' ' CZ ' ' A' ' 6' ' ' ARG . 4.7 m-20 -82.72 128.86 34.77 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.665 -0.698 . . . . 72.510000000000005 110.222 171.729 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.7 mt -139.56 109.42 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.77 0.319 . . . . 74.549999999999997 111.146 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.672 ' HG3' ' HA ' ' A' ' 43' ' ' GLU . 2.4 mpt_? -119.45 125.41 48.87 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 122.104 -0.373 . . . . 74.420000000000002 111.975 -179.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -109.11 145.56 35.49 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 116.26 -0.427 . . . . 74.140000000000001 111.498 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -142.5 120.09 11.77 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.316 -0.253 . . . . 74.5 110.316 172.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -148.73 159.68 28.12 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.649 -0.786 . . . . 52.399999999999999 113.693 -176.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.98 -13.02 34.17 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.148 0.425 . . . . 73.530000000000001 112.148 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.27 161.08 25.3 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.039 0.447 . . . . 65.310000000000002 111.933 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.3 tp -85.51 -58.51 2.64 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.948 0.404 . . . . 75.319999999999993 111.674 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.475 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 41.4 mt-10 -66.78 -30.25 70.41 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 111.979 0.363 . . . . 62.310000000000002 111.979 -175.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.2 -33.17 51.64 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.997 0.369 . . . . 64.010000000000005 111.997 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.408 ' CE1' HD13 ' A' ' 37' ' ' LEU . 77.4 t80 -59.68 -53.56 56.64 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.109 0.481 . . . . 72.439999999999998 111.213 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -73.78 -36.9 65.11 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.016 -0.538 . . . . 74.400000000000006 111.906 -176.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 75.2 mmtt -59.59 -54.21 49.12 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.948 0.404 . . . . 63.340000000000003 111.306 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.48 -47.76 84.74 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.255 -0.43 . . . . 70.439999999999998 111.724 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.32 -45.44 91.32 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.026 0.441 . . . . 64.340000000000003 111.55 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -64.07 -42.91 96.83 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.303 -0.408 . . . . 73.439999999999998 111.653 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -61.8 -46.51 89.23 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.103 0.408 . . . . 73.530000000000001 112.103 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.463 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 78.2 mmm -56.52 -44.8 81.14 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.845 0.355 . . . . 75.540000000000006 111.196 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.531 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.9 mt -66.13 -43.43 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 121.054 0.454 . . . . 75.409999999999997 110.936 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -53.02 -54.68 31.77 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.229 0.612 . . . . 73.329999999999998 112.017 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.07 -37.75 84.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.774 0.321 . . . . 73.010000000000005 111.512 176.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.24 -25.24 65.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.222 0.452 . . . . 71.409999999999997 112.222 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 11.8 mmm180 -56.59 -27.79 58.8 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.142 0.423 . . . . 74.319999999999993 112.142 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -61.96 -25.56 67.68 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 111.788 0.292 . . . . 72.129999999999995 111.788 178.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.434 ' CZ ' HG21 ' A' ' 53' ' ' VAL . 23.4 m-85 -118.06 171.73 7.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.449 0.642 . . . . 74.109999999999999 112.074 -173.761 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.16 90.52 3.96 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.047 -0.524 . . . . 75.030000000000001 110.574 173.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -152.17 164.7 30.58 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 120.975 -0.631 . . . . 52.0 113.355 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -95.95 123.26 39.47 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.777 0.322 . . . . 73.530000000000001 111.594 -177.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t -115.31 119.35 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 116.255 -0.429 . . . . 71.400000000000006 110.552 175.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -130.87 164.48 25.14 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.701 0.286 . . . . 73.420000000000002 111.426 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.522 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.9 p90 -155.23 146.97 23.25 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.007 0.432 . . . . 73.549999999999997 111.683 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.518 HG23 ' HB3' ' A' ' 43' ' ' GLU . 0.7 OUTLIER -137.32 137.38 38.88 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.886 0.374 . . . . 74.140000000000001 111.406 178.395 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.408 HD13 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.4 130.47 34.64 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.914 0.388 . . . . 73.519999999999996 111.568 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.58 106.32 7.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.992 0.425 . . . . 75.150000000000006 110.878 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.47 -97.0 0.22 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 121.229 -0.51 . . . . 54.329999999999998 113.335 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -125.29 11.14 8.08 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.132 0.419 . . . . 73.420000000000002 112.132 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -132.67 158.96 40.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.353 0.597 . . . . 64.150000000000006 112.407 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.522 HD11 ' HB2' ' A' ' 35' ' ' TYR . 64.0 tp -109.08 125.29 51.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.778 -0.647 . . . . 74.329999999999998 111.604 -177.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.672 ' HA ' ' HG3' ' A' ' 6' ' ' ARG . 1.5 tm-20 -101.87 108.37 19.82 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 110.471 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -108.6 139.78 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.08 0.466 . . . . 74.120000000000005 112.245 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -125.28 123.28 39.13 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.072 -0.513 . . . . 74.439999999999998 110.763 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.59 121.83 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.819 0.343 . . . . 73.439999999999998 111.45 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.512 HG23 ' HG2' ' A' ' 2' ' ' GLU . 86.2 m -121.86 126.74 49.41 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.28 -0.418 . . . . 74.549999999999997 111.601 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.15 55.32 0.51 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.238 -0.506 . . . . 73.120000000000005 113.941 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.472 HG22 ' HE2' ' A' ' 1' ' ' MET . 24.7 m -133.58 144.37 51.82 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.356 -0.497 . . . . 74.25 111.783 -179.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.83 162.83 10.53 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.909 2.406 . . . . 72.400000000000006 113.598 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.55 -37.06 84.64 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.361 0.504 . . . . 74.409999999999997 112.361 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -60.3 -18.53 50.07 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.736 0.643 . . . . 74.299999999999997 112.736 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.531 HG12 ' HG ' ' A' ' 57' ' ' LEU . 16.4 t -112.42 -2.68 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.397 0.617 . . . . 62.329999999999998 111.066 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.658 ' NH2' ' SD ' ' A' ' 3' ' ' MET . 5.3 tpm_? -52.59 -58.38 6.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.87 -0.604 . . . . 74.25 112.525 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -66.05 -33.34 75.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.036 -0.529 . . . . 75.530000000000001 111.625 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.85 -50.56 70.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.21 -0.45 . . . . 72.430000000000007 111.235 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.531 ' HG ' HG12 ' A' ' 53' ' ' VAL . 98.7 mt -61.36 -38.48 87.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.931 0.396 . . . . 73.219999999999999 111.206 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.437 ' HA ' ' HE3' ' A' ' 3' ' ' MET . . . -61.12 -42.26 98.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 111.678 178.55 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 62' ' ' GLU . 22.0 ttmm -78.51 -32.73 48.26 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 120.903 0.383 . . . . 53.329999999999998 111.954 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' A' ' 63' ' ' ARG . 29.1 tt0 -64.16 -32.87 74.61 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.952 -0.467 . . . . 72.109999999999999 110.555 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.4 -38.41 74.25 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.372 -0.377 . . . . 73.150000000000006 110.845 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.433 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 43.5 mt-10 -59.64 -43.72 93.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.979 0.419 . . . . 72.129999999999995 110.574 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 33.8 ttm180 -54.95 -54.0 48.38 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.28 -0.418 . . . . 71.140000000000001 111.347 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 18' ' ' ALA . 93.5 mt -56.42 -39.19 72.65 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 75.319999999999993 111.687 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.14 -57.13 4.51 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.069 0.461 . . . . 73.230000000000004 111.938 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.82 -24.86 66.22 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.52 . . . . 74.230000000000004 112.403 -174.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.532 ' HB2' ' O ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -61.18 -47.92 83.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.116 0.484 . . . . 72.450000000000003 110.587 179.211 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -104.27 8.68 36.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.152 -0.476 . . . . 74.239999999999995 111.396 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 60.96 24.92 14.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.494 0.553 . . . . 74.019999999999996 112.494 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.2 pt -87.77 166.43 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.006 0.431 . . . . 75.510000000000005 111.673 -177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.2 m -87.54 142.5 27.8 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.48 -0.327 . . . . 72.299999999999997 111.366 -178.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 14.6 p -143.62 134.97 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.135 0.493 . . . . 62.520000000000003 111.839 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -119.43 123.09 43.22 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.697 -0.483 . . . . 74.540000000000006 109.697 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.431 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 34.0 p90 -128.46 135.32 49.3 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.232 0.539 . . . . 74.230000000000004 111.829 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.401 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 86.6 m -133.39 148.55 51.82 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.888 -0.596 . . . . 64.129999999999995 110.781 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.9 mm -101.99 114.28 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.907 0.384 . . . . 74.400000000000006 111.196 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.637 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 13.7 mtp180 -84.58 106.61 16.28 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.177 0.436 . . . . 74.109999999999999 112.177 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -103.3 158.91 16.0 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.018 -0.537 . . . . 75.349999999999994 110.049 170.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -72.57 139.91 47.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.519 -0.31 . . . . 71.25 110.897 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -75.22 67.92 1.9 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 122.075 0.94 . . . . 54.200000000000003 109.112 172.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -65.96 133.31 50.59 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 114.711 -1.131 . . . . 62.299999999999997 111.633 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -72.24 102.23 3.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.038 -0.528 . . . . 73.219999999999999 110.515 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -152.29 139.26 19.07 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.209 -0.45 . . . . 74.409999999999997 111.551 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -124.89 177.71 5.88 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.115 -0.493 . . . . 74.420000000000002 110.35 177.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 . . . . . 0 C--O 1.248 1.026 0 O-C-N 122.361 -0.212 . . . . 75.319999999999993 111.407 177.352 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 tmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.806 -0.442 . . . . 73.129999999999995 109.806 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -102.58 148.72 25.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.926 0.394 . . . . 73.319999999999993 111.469 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.7 ttt -124.36 124.44 42.37 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.146 0.498 . . . . 74.239999999999995 112.123 -176.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -106.12 115.34 30.06 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.967 -0.56 . . . . 64.239999999999995 110.798 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.2 mt -120.72 141.69 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.42 0.288 . . . . 64.450000000000003 111.089 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.472 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 26.4 mtm105 -144.37 122.63 12.26 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.153 0.427 . . . . 70.310000000000002 112.153 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.446 ' O ' ' HA ' ' A' ' 41' ' ' ASP . 95.8 m-85 -103.13 125.43 49.83 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.473 -0.33 . . . . 72.430000000000007 111.628 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.502 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 8.2 tpt180 -104.33 119.33 38.73 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.813 0.34 . . . . 75.239999999999995 110.616 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.43 146.63 9.64 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 121.235 -0.507 . . . . 74.430000000000007 113.029 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -94.28 3.07 55.73 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 122.461 -0.434 . . . . 62.219999999999999 112.111 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.08 134.27 37.75 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.089 0.471 . . . . 71.420000000000002 111.991 177.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -71.3 -52.76 17.07 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.218 -0.446 . . . . 54.450000000000003 111.606 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.29 -31.2 67.26 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.783 0.325 . . . . 65.209999999999994 111.792 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.97 -40.14 69.73 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.518 -0.31 . . . . 73.439999999999998 111.69 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -56.64 -54.26 48.1 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.904 0.383 . . . . 74.140000000000001 111.333 176.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.02 -49.95 70.38 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.355 -0.384 . . . . 71.439999999999998 111.765 -178.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 70.3 mmtt -61.87 -54.57 40.29 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.331 0.493 . . . . 75.530000000000001 112.331 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.494 ' HA ' HD23 ' A' ' 64' ' ' LEU . . . -57.71 -48.55 79.24 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.82 0.343 . . . . 64.510000000000005 111.879 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.72 -44.68 92.87 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.856 0.36 . . . . 74.349999999999994 111.333 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -62.49 -46.01 90.39 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.966 0.358 . . . . 71.120000000000005 111.966 -177.236 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 25.7 mm-40 -64.82 -45.54 85.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.634 0.254 . . . . 75.140000000000001 111.557 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.497 ' HE2' ' HA ' ' A' ' 22' ' ' MET . 1.6 mmt -55.8 -50.64 69.94 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.125 0.488 . . . . 73.120000000000005 111.017 176.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.561 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 64.9 mt -62.18 -42.47 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.269 -0.423 . . . . 73.450000000000003 111.429 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.7 ttm-85 -49.28 -48.12 46.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.108 0.48 . . . . 65.140000000000001 111.474 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -68.43 -46.08 70.84 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.939 -0.573 . . . . 75.420000000000002 111.829 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.37 -22.39 63.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.225 0.824 . . . . 52.32 113.225 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.561 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 37.1 mtp85 -56.68 -28.66 61.21 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 112.777 0.658 . . . . 74.239999999999995 112.777 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.413 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 0.4 OUTLIER -74.78 -20.95 59.58 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.969 0.359 . . . . 71.230000000000004 111.969 179.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -106.73 178.0 4.69 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.393 0.616 . . . . 62.210000000000001 112.181 -173.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -89.94 28.07 1.45 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.953 -0.567 . . . . 62.43 111.269 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.16 128.87 9.63 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 116.074 -0.512 . . . . 74.299999999999997 113.182 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 96.2 m -88.49 117.37 27.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.883 0.373 . . . . 73.430000000000007 111.026 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.492 HG22 HG12 ' A' ' 46' ' ' ILE . 77.1 t -103.41 109.79 28.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 120.996 0.427 . . . . 72.420000000000002 111.225 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.4 t -110.86 157.06 20.26 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.361 -0.381 . . . . 74.239999999999995 110.894 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.425 ' HB2' HD11 ' A' ' 42' ' ' LEU . 29.3 p90 -140.96 133.87 29.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.128 0.489 . . . . 75.120000000000005 112.1 -176.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 p -129.61 130.54 45.78 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.078 -0.51 . . . . 72.420000000000002 110.528 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -91.36 120.35 32.15 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.946 0.35 . . . . 64.329999999999998 111.946 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -113.25 88.97 2.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.941 0.4 . . . . 71.430000000000007 109.973 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.68 -101.2 0.23 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.167 -0.54 . . . . 72.439999999999998 113.558 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -109.03 13.21 24.76 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.584 -0.363 . . . . 70.420000000000002 111.669 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.446 ' HA ' ' O ' ' A' ' 7' ' ' PHE . 21.8 t70 -119.47 121.85 40.38 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.134 0.492 . . . . 74.420000000000002 110.654 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.425 HD11 ' HB2' ' A' ' 35' ' ' TYR . 41.5 tp -94.47 106.84 18.83 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.194 -0.457 . . . . 75.040000000000006 110.897 178.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.472 ' HG2' ' HG2' ' A' ' 6' ' ' ARG . 36.2 mt-10 -85.06 103.85 14.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.97 0.414 . . . . 70.299999999999997 111.068 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 113.2 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 120.984 0.421 . . . . 75.239999999999995 111.066 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -109.06 120.82 43.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.813 0.339 . . . . 72.140000000000001 111.154 -178.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.492 HG12 HG22 ' A' ' 33' ' ' VAL . 53.4 mt -110.99 112.39 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 120.942 0.401 . . . . 74.430000000000007 111.214 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 73.0 m -107.01 132.49 52.88 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.186 0.439 . . . . 71.230000000000004 112.186 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.86 62.02 1.88 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.409 -0.424 . . . . 74.5 114.152 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 m -133.01 139.03 33.16 Favored Pre-proline 0 CA--C 1.545 0.773 0 O-C-N 122.481 -0.423 . . . . 75.040000000000006 111.944 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -58.05 132.61 50.44 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.738 2.292 . . . . 74.329999999999998 113.081 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -52.11 -36.4 50.94 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.076 0.769 . . . . 62.109999999999999 113.076 -174.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -67.2 -34.76 78.19 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 120.803 0.335 . . . . 73.450000000000003 111.871 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.2 t -75.21 -19.19 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 121.105 0.478 . . . . 74.040000000000006 111.185 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -50.6 -36.47 35.13 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.044 -0.526 . . . . 74.439999999999998 111.971 177.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -61.91 -43.08 99.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.702 -0.226 . . . . 73.329999999999998 111.496 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -64.61 -43.35 94.05 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.802 0.334 . . . . 72.340000000000003 111.121 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.8 -42.61 99.23 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.02 0.438 . . . . 74.420000000000002 111.05 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.401 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -67.87 -45.33 74.82 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 65.319999999999993 111.591 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -65.95 -32.82 74.53 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 75.129999999999995 111.427 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.59 -45.46 93.88 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.641 -0.503 . . . . 74.129999999999995 109.641 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.75 97.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.137 -0.483 . . . . 52.240000000000002 111.541 176.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-10 -55.54 -45.51 77.19 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.279 0.561 . . . . 74.010000000000005 110.533 175.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -64.98 -49.51 69.99 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.584 -0.735 . . . . 74.209999999999994 111.412 179.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 18' ' ' ALA . 91.8 mt -54.43 -45.2 72.97 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.029 0.381 . . . . 73.519999999999996 112.029 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.27 -56.72 15.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.807 0.337 . . . . 74.519999999999996 111.724 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -61.85 -35.75 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.147 0.425 . . . . 75.319999999999993 112.147 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.74 -34.94 73.61 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.03 0.443 . . . . 72.040000000000006 111.243 -178.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -105.71 0.04 25.9 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.349 -0.387 . . . . 72.310000000000002 111.553 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 61.17 21.62 12.04 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.113 0.565 . . . . 71.430000000000007 112.078 -177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.439 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 33.2 pt -86.92 175.34 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.015 0.436 . . . . 75.099999999999994 111.239 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.502 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 22.8 m -93.54 146.42 23.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.738 0.304 . . . . 73.109999999999999 111.318 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.2 p -137.6 139.57 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.148 0.499 . . . . 75.109999999999999 111.518 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.9 p -132.49 143.13 49.55 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.086 -0.507 . . . . 72.319999999999993 110.097 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -147.57 134.13 19.82 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.213 0.53 . . . . 74.120000000000005 111.916 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.3 p -121.08 145.0 48.25 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.957 -0.565 . . . . 71.340000000000003 110.822 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.7 mm -117.26 144.78 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.626 -0.261 . . . . 75.540000000000006 110.945 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -143.39 141.36 30.86 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.234 0.54 . . . . 73.219999999999999 111.66 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.4 tp -104.67 120.45 41.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.974 -0.557 . . . . 75.019999999999996 110.061 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.59 94.03 0.08 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.978 0.418 . . . . 74.25 111.393 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -154.37 120.39 5.29 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.356 -0.384 . . . . 74.140000000000001 110.946 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -79.55 99.64 7.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.097 0.475 . . . . 64.239999999999995 111.503 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -68.98 92.01 0.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.32 -0.4 . . . . 73.010000000000005 111.134 177.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -73.09 128.58 35.89 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.86 0.362 . . . . 72.519999999999996 111.318 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -88.92 136.53 32.96 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.913 0.387 . . . . 73.519999999999996 111.866 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.826 -0.607 . . . . 74.420000000000002 111.169 175.964 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.632 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.0 mtp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.14 0.495 . . . . 74.530000000000001 111.558 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -133.43 147.4 51.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.005 -0.543 . . . . 74.450000000000003 109.586 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.457 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 28.6 ttt -148.88 118.99 7.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.092 0.775 . . . . 72.400000000000006 113.092 -173.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.401 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 6.5 m-20 -87.97 119.39 28.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.445 -0.343 . . . . 64.510000000000005 110.38 172.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.449 HG12 ' HE3' ' A' ' 3' ' ' MET . 51.2 mt -116.33 108.4 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.032 0.444 . . . . 74.340000000000003 111.064 178.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.42 ' HG2' ' HB2' ' A' ' 43' ' ' GLU . 61.8 mtm-85 -98.56 102.1 13.74 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.575 0.583 . . . . 74.200000000000003 112.575 -176.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -85.78 143.24 28.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.454 -0.339 . . . . 73.230000000000004 110.305 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.56 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 43.9 ttt180 -141.47 118.88 11.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.564 0.221 . . . . 73.329999999999998 110.599 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.96 153.19 24.65 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.194 -0.527 . . . . 63.109999999999999 113.136 -176.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -97.49 -14.27 21.22 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.045 0.757 . . . . 64.230000000000004 113.045 -174.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.464 ' CG ' ' H ' ' A' ' 12' ' ' LEU . 7.2 p-10 -72.66 -91.13 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 112.87 0.693 . . . . 75.310000000000002 112.87 -174.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.464 ' H ' ' CG ' ' A' ' 11' ' ' ASP . 57.9 tp 171.14 -51.82 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.145 0.578 . . . . 74.549999999999997 110.04 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.546 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 48.7 mt-10 -62.39 -29.93 70.84 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.652 -0.704 . . . . 54.039999999999999 111.687 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.71 -39.67 62.27 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.817 0.342 . . . . 75.319999999999993 111.383 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -62.47 -60.53 3.42 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.928 0.394 . . . . 75.010000000000005 111.574 176.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -63.12 -50.51 70.2 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.499 0.555 . . . . 74.400000000000006 112.499 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.546 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 65.0 mmtt -67.02 -46.1 75.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 111.742 0.275 . . . . 74.310000000000002 111.742 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.421 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -63.96 -46.21 85.7 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.781 0.324 . . . . 74.120000000000005 111.369 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.03 -47.23 78.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.017 0.437 . . . . 73.540000000000006 110.566 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -52.07 -55.92 17.66 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.704 -0.68 . . . . 74.129999999999995 112.166 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.89 -42.5 97.44 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.157 0.429 . . . . 73.209999999999994 112.157 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.421 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 77.6 mmm -61.94 -45.16 94.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.636 0.255 . . . . 74.420000000000002 111.294 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.444 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 66.7 mt -60.36 -40.45 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.733 0.302 . . . . 75.299999999999997 110.634 175.283 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -56.6 -41.98 77.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.866 0.365 . . . . 73.420000000000002 111.041 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -69.28 -42.87 74.94 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.059 0.457 . . . . 72.450000000000003 111.183 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.82 -35.52 81.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.377 -0.374 . . . . 72.129999999999995 111.816 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.444 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 41.4 mtp85 -64.36 -28.88 70.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.189 0.44 . . . . 73.450000000000003 112.189 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -55.32 -43.39 74.87 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.285 0.564 . . . . 73.430000000000007 110.491 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -97.84 -6.15 33.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.773 -0.649 . . . . 74.219999999999999 111.838 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 60.17 42.83 14.84 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.053 0.454 . . . . 64.140000000000001 111.922 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -87.57 -175.96 48.45 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.268 -0.491 . . . . 72.340000000000003 113.784 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.6 m -94.76 131.45 40.58 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.649 0.38 . . . . 74.310000000000002 111.315 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.34 125.56 70.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 112.165 0.431 . . . . 62.310000000000002 112.165 -178.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -136.26 144.83 45.01 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.217 -0.447 . . . . 72.120000000000005 110.773 173.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.438 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 44.3 p90 -142.84 140.68 31.38 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.566 0.58 . . . . 73.109999999999999 112.566 -176.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 p -115.24 141.83 47.49 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 116.01 -0.541 . . . . 74.109999999999999 111.696 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -113.36 125.73 54.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.031 0.443 . . . . 74.430000000000007 112.067 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.47 96.35 2.97 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.29 -0.414 . . . . 73.209999999999994 110.346 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.89 -101.12 0.62 Allowed Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.993 -0.622 . . . . 61.219999999999999 112.862 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -110.04 3.93 20.81 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.973 0.416 . . . . 74.209999999999994 110.992 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -93.8 130.74 39.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.097 -0.502 . . . . 73.109999999999999 112.044 -175.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.1 tp -131.68 101.55 5.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.097 -0.502 . . . . 74.510000000000005 110.955 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.438 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.5 tt0 -97.27 108.77 21.57 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.884 0.374 . . . . 75.010000000000005 111.116 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.8 mt -101.95 108.57 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.226 -0.443 . . . . 73.349999999999994 110.867 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -93.11 111.3 22.89 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.878 0.371 . . . . 72.099999999999994 110.684 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.7 mt -101.98 110.41 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.312 0.577 . . . . 65.239999999999995 110.734 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -97.84 130.44 44.75 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 73.049999999999997 111.154 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.05 -15.88 15.82 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 120.95 -0.643 . . . . 62.130000000000003 113.558 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.894 HG22 HH22 ' A' ' 54' ' ' ARG . 15.1 m -61.2 138.64 94.5 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-N 117.221 0.511 . . . . 73.109999999999999 112.086 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.62 -176.87 3.2 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.191 2.594 . . . . 75.25 114.286 -173.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.632 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 10.2 pt-20 -90.49 -50.48 5.92 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.581 0.585 . . . . 64.299999999999997 112.581 -176.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -64.11 -40.5 96.33 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.649 0.611 . . . . 70.439999999999998 112.649 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.421 HG11 ' O ' ' A' ' 53' ' ' VAL . 22.8 t -73.58 -3.33 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 CA-C-O 120.955 0.407 . . . . 75.299999999999997 111.847 -177.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.894 HH22 HG22 ' A' ' 49' ' ' VAL . 18.4 tpp180 -51.22 -35.39 36.53 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.127 0.417 . . . . 72.319999999999993 112.127 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -55.76 -53.59 54.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.255 0.55 . . . . 75.420000000000002 111.378 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -74.54 -32.86 62.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.158 -0.474 . . . . 72.319999999999993 111.864 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.3 mt -56.75 -43.66 80.97 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.114 0.483 . . . . 74.340000000000003 111.065 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.07 73.29 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.026 0.441 . . . . 74.420000000000002 111.109 175.052 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -56.52 -39.61 73.64 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.961 -0.563 . . . . 75.329999999999998 111.94 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -64.81 -48.22 75.19 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.908 0.385 . . . . 44.32 110.904 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.28 -43.9 88.21 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.155 -0.475 . . . . 61.25 111.264 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.438 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 49.5 mt-10 -60.96 -42.14 97.72 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.309 -0.405 . . . . 72.409999999999997 111.168 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.571 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 27.9 ttm180 -55.26 -54.9 37.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.69 0.281 . . . . 75.439999999999998 110.653 174.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.5 mt -52.63 -45.9 66.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.17 -0.468 . . . . 72.299999999999997 111.675 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.67 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.402 -0.363 . . . . 72.5 111.85 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.438 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 34.0 mmtp -72.3 -30.23 64.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.178 0.436 . . . . 65.150000000000006 112.178 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.7 mm-40 -61.9 -38.51 88.62 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 122.118 -0.364 . . . . 73.430000000000007 111.598 178.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -100.87 -5.89 25.48 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.862 0.319 . . . . 70.150000000000006 111.862 178.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 56.64 60.03 3.28 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.643 0.735 . . . . 75.400000000000006 110.551 -173.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.56 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 39.6 pt -125.39 -176.37 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 115.502 -0.772 . . . . 73.230000000000004 111.28 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.46 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.5 m -98.89 141.42 31.69 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.596 -0.275 . . . . 61.299999999999997 111.712 -177.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.1 p -142.03 129.26 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.449 0.642 . . . . 74.409999999999997 111.792 176.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -129.87 123.29 30.47 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 116.12 -0.491 . . . . 74.319999999999993 110.273 175.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.401 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.7 p90 -125.57 136.63 53.5 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.523 0.677 . . . . 75.5 112.734 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 64.9 m -103.56 123.16 46.43 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.512 -0.767 . . . . 64.049999999999997 110.936 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.625 HD11 ' HD2' ' A' ' 54' ' ' ARG . 42.4 mm -94.22 114.13 30.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.68 0.276 . . . . 75.230000000000004 111.67 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -104.43 111.07 23.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.952 0.406 . . . . 74.099999999999994 111.317 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.714 ' H ' HD21 ' A' ' 78' ' ' LEU . 2.2 pt? -92.17 136.55 33.09 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 110.06 -0.348 . . . . 74.519999999999996 110.06 173.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.04 120.26 12.3 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.077 0.465 . . . . 75.0 110.903 -176.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -71.1 120.33 16.51 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.683 0.623 . . . . 65.340000000000003 112.683 -171.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -135.92 127.2 28.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.905 -0.589 . . . . 72.230000000000004 109.884 173.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.51 ' HD2' ' HB3' ' A' ' 85' ' ' HIS . 68.5 t60 -70.42 95.93 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.709 0.633 . . . . 73.219999999999999 112.709 -171.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -71.63 173.11 8.52 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.495 -0.32 . . . . 72.439999999999998 110.727 171.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 62.77 29.45 16.72 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 121.009 0.433 . . . . 73.439999999999998 110.823 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . 0.51 ' HB3' ' HD2' ' A' ' 82' ' ' HIS . 17.1 p-80 . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.533 -0.746 . . . . 73.319999999999993 112.18 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.536 ' HE3' ' HB2' ' A' ' 54' ' ' ARG . 6.3 tmm? . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 110.062 -0.347 . . . . 74.329999999999998 110.062 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.528 ' N ' ' SD ' ' A' ' 1' ' ' MET . 26.5 mt-10 -132.62 137.71 47.13 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.072 0.463 . . . . 72.430000000000007 111.788 -175.556 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.559 ' HE2' HD12 ' A' ' 5' ' ' ILE . 26.3 ttt -139.33 106.91 5.58 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.943 -0.571 . . . . 74.409999999999997 111.247 -170.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.477 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 16.0 m-20 -90.89 106.93 18.86 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.476 0.311 . . . . 63.32 111.39 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.559 HD12 ' HE2' ' A' ' 3' ' ' MET . 36.9 mm -97.51 109.3 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.706 0.289 . . . . 75.340000000000003 111.208 179.543 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 2.5 ttp180 -118.67 116.35 26.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.325 0.583 . . . . 74.540000000000006 112.097 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -95.15 142.57 27.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.839 -0.618 . . . . 74.510000000000005 111.379 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -141.91 121.11 13.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 111.222 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.61 -165.22 36.47 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.964 -0.636 . . . . 36.170000000000002 113.311 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -123.66 102.13 7.67 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 122.48 -0.424 . . . . 71.239999999999995 111.867 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' A' ' 14' ' ' ALA . 19.3 t70 -176.82 141.86 0.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.051 -0.522 . . . . 75.340000000000003 110.416 175.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.1 tp -76.01 -44.48 39.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 111.97 0.359 . . . . 74.450000000000003 111.97 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.503 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 4.8 mp0 -73.97 -27.52 61.03 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 112.1 0.407 . . . . 53.43 112.1 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.431 ' HB2' ' HB3' ' A' ' 11' ' ' ASP . . . -52.99 -47.59 68.12 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.193 0.812 . . . . 74.519999999999996 113.193 -173.358 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -60.95 -61.27 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.22 0.452 . . . . 65.439999999999998 112.22 -176.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.46 -39.38 91.93 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.597 0.591 . . . . 73.400000000000006 112.597 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 10.5 mmmt -65.83 -52.93 46.41 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.27 0.47 . . . . 71.519999999999996 112.27 -179.412 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.8 88.19 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.294 0.568 . . . . 64.340000000000003 110.791 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 tp -63.26 -41.44 99.05 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.682 -0.69 . . . . 73.329999999999998 111.43 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -57.22 -48.46 78.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.157 -0.474 . . . . 75.049999999999997 111.935 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -60.61 -44.87 95.81 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.09 0.472 . . . . 74.319999999999993 111.384 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 96.3 mmm -61.53 -49.08 78.15 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.192 -0.458 . . . . 73.420000000000002 111.525 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.82 -37.68 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 120.741 0.305 . . . . 73.349999999999994 111.366 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -53.67 -47.9 69.96 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.892 0.377 . . . . 75.540000000000006 111.119 177.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.627 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 72.2 mm-40 -74.35 -40.16 62.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.322 -0.399 . . . . 64.239999999999995 111.276 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.13 -38.58 79.97 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.308 0.484 . . . . 64.140000000000001 112.308 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -59.92 -29.55 68.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.061 0.458 . . . . 73.019999999999996 111.466 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.627 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 50.7 mtpt -72.22 -13.81 61.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 111.759 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -110.46 -177.26 3.19 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.013 0.435 . . . . 74.209999999999994 111.167 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -96.93 -10.72 25.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.765 0.317 . . . . 63.310000000000002 111.746 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.34 150.61 51.95 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.488 -0.387 . . . . 74.109999999999999 113.76 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 144.52 27.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.028 0.442 . . . . 64.129999999999995 111.518 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG21 HG22 ' A' ' 46' ' ' ILE . 84.5 t -129.36 131.61 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.161 -0.472 . . . . 53.530000000000001 111.045 178.15 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -131.8 140.25 49.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.733 0.302 . . . . 71.310000000000002 110.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -131.8 151.48 51.64 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.291 0.478 . . . . 75.0 112.291 -174.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 t -137.26 131.68 32.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.062 -0.517 . . . . 72.010000000000005 111.33 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.404 HD12 HD12 ' A' ' 42' ' ' LEU . 4.0 mm? -100.91 123.61 45.36 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.947 0.403 . . . . 75.340000000000003 111.271 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -121.7 83.86 2.16 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.26 0.552 . . . . 71.319999999999993 110.209 174.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.23 -101.2 0.3 Allowed Glycine 0 CA--C 1.528 0.857 0 CA-C-N 115.752 -0.658 . . . . 62.409999999999997 113.159 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -108.58 21.77 16.84 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.059 0.457 . . . . 55.109999999999999 111.437 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -127.94 140.5 51.96 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 116.087 -0.506 . . . . 73.109999999999999 110.377 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.422 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 31.7 tp -134.17 118.81 18.07 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.104 0.409 . . . . 74.329999999999998 112.104 -177.24 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -108.83 131.77 54.66 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.641 0.257 . . . . 72.200000000000003 110.743 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -127.11 109.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 120.88 0.372 . . . . 74.329999999999998 110.981 -179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 45' ' ' ARG . 15.2 ttp85 -92.48 108.54 20.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.002 0.429 . . . . 73.209999999999994 111.402 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.443 HG22 HG21 ' A' ' 33' ' ' VAL . 58.2 mt -102.74 136.63 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 116.11 -0.496 . . . . 61.509999999999998 111.369 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.8 m -144.04 121.77 11.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 122.24 -0.288 . . . . 73.340000000000003 111.386 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 133.04 -27.8 3.41 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 120.87 -0.681 . . . . 62.450000000000003 114.275 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.3 m -71.24 134.64 84.91 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 122.238 -0.566 . . . . 72.239999999999995 111.7 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.97 153.91 74.08 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.719 2.279 . . . . 64.209999999999994 113.512 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -31.24 64.34 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.555 0.946 . . . . 62.409999999999997 113.555 -175.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -71.83 -33.88 68.84 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.411 0.523 . . . . 72.010000000000005 112.411 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -81.41 -30.12 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 121.186 0.517 . . . . 73.109999999999999 110.677 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.536 ' HB2' ' HE3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -49.09 -45.75 43.69 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.591 -0.731 . . . . 73.340000000000003 112.194 177.357 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -65.18 -31.03 72.0 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.865 0.364 . . . . 64.230000000000004 111.712 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -71.51 -44.67 64.24 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.091 0.472 . . . . 74.349999999999994 110.233 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.34 -35.78 81.52 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.045 -0.525 . . . . 72.450000000000003 111.15 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.38 -45.05 95.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.996 0.427 . . . . 74.310000000000002 111.247 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.2 -43.71 87.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.168 -0.469 . . . . 73.230000000000004 110.85 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.65 -42.23 86.97 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.132 -0.486 . . . . 74.5 111.191 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.79 -45.42 78.22 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.993 0.425 . . . . 71.200000000000003 111.418 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -64.99 -36.47 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.987 0.422 . . . . 72.239999999999995 111.034 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.412 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 9.9 tpp180 -59.49 -48.04 83.18 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.249 -0.432 . . . . 74.099999999999994 110.26 175.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.29 -43.6 74.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.695 -0.684 . . . . 75.019999999999996 111.627 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.56 75.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.185 0.517 . . . . 64.219999999999999 111.278 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.32 -38.01 86.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.966 -0.561 . . . . 73.299999999999997 111.409 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 8.1 mm-40 -53.27 -35.4 60.01 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.409 -0.36 . . . . 75.239999999999995 111.834 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -114.74 6.19 15.51 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.315 0.487 . . . . 73.329999999999998 112.315 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.529 ' N ' HD21 ' A' ' 69' ' ' ASN . 0.8 OUTLIER 60.83 24.97 14.89 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.844 0.354 . . . . 74.150000000000006 111.834 179.499 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -101.49 -179.51 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.902 0.382 . . . . 75.420000000000002 111.506 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 95.6 m -102.67 131.75 49.25 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.8 0.333 . . . . 74.409999999999997 111.778 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -111.09 134.2 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.261 0.553 . . . . 74.540000000000006 111.228 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.9 p -130.84 121.1 24.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.951 -0.568 . . . . 73.239999999999995 110.224 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 17.0 p90 -129.5 129.35 44.44 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.366 0.603 . . . . 64.439999999999998 112.51 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.9 m -103.73 119.17 38.36 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.561 -0.745 . . . . 73.099999999999994 110.518 178.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.536 HG12 ' HG3' ' A' ' 3' ' ' MET . 24.2 mt -122.95 133.83 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 122.063 -0.398 . . . . 73.420000000000002 112.029 -175.468 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -127.29 137.03 52.74 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.122 0.487 . . . . 73.140000000000001 111.155 175.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.526 ' H ' HD21 ' A' ' 78' ' ' LEU . 2.1 pt? -135.45 165.11 26.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.037 -0.529 . . . . 71.540000000000006 110.962 178.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.5 97.12 0.41 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.252 0.549 . . . . 74.329999999999998 111.862 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -97.16 119.92 36.55 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.386 -0.37 . . . . 74.239999999999995 111.279 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.1 m80 -89.8 117.6 28.77 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.008 0.432 . . . . 75.140000000000001 111.702 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -74.99 75.98 2.2 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.118 0.485 . . . . 75.420000000000002 111.515 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.3 p80 -88.18 153.71 21.02 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.321 -0.4 . . . . 64.439999999999998 110.988 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -93.21 -176.54 4.18 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.892 0.377 . . . . 73.430000000000007 111.534 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.997 -0.525 . . . . 74.25 111.312 179.628 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.773 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 35.5 ttm . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.705 0.288 . . . . 75.420000000000002 111.022 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.403 ' CD ' HH21 ' A' ' 77' ' ' ARG . 37.6 tt0 -127.2 132.63 50.42 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.683 0.278 . . . . 65.420000000000002 110.631 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.54 ' HG3' HG12 ' A' ' 76' ' ' ILE . 25.9 ttt -130.14 118.09 20.94 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 120.826 0.346 . . . . 73.219999999999999 111.576 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.52 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 13.4 t70 -97.49 114.66 26.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.832 0.453 . . . . 51.299999999999997 110.796 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.437 HD12 ' HE3' ' A' ' 22' ' ' MET . 62.2 mt -121.84 113.54 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 122.372 0.269 . . . . 70.25 111.462 -177.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.515 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 6.0 ptm180 -106.93 138.06 43.82 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.136 0.493 . . . . 73.310000000000002 112.16 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.93 142.19 44.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.031 -0.531 . . . . 73.239999999999995 110.996 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.523 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 26.4 ttt85 -142.46 132.43 24.41 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.591 -0.277 . . . . 74.340000000000003 110.722 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.439 ' HA3' HG23 ' A' ' 70' ' ' ILE . . . -179.37 -165.48 33.61 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 120.441 -0.885 . . . . 75.310000000000002 113.949 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.23 -19.91 12.07 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 122.697 0.399 . . . . 74.120000000000005 111.885 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.3 118.2 8.31 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.18 0.514 . . . . 75.219999999999999 112.353 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.06 -61.01 2.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.978 -0.555 . . . . 65.109999999999999 112.352 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 43.5 tt0 -60.48 -26.64 66.96 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.057 0.391 . . . . 70.049999999999997 112.057 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.41 -28.79 31.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.676 0.274 . . . . 50.399999999999999 111.351 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.68 -60.36 3.67 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.336 -0.393 . . . . 73.5 111.337 174.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -71.01 -28.57 64.5 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.514 -0.312 . . . . 74.049999999999997 111.649 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.544 ' HG2' ' HG2' ' A' ' 13' ' ' GLU . 31.8 mmmt -67.76 -54.91 15.46 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.863 0.363 . . . . 74.230000000000004 111.082 177.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -64.84 -51.59 61.24 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.261 -0.427 . . . . 73.150000000000006 111.437 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.97 -48.35 70.42 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.901 0.381 . . . . 74.510000000000005 111.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -60.85 -45.98 92.37 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.351 -0.386 . . . . 63.549999999999997 111.816 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 25' ' ' GLN . 17.3 mm-40 -64.15 -44.92 90.63 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.871 0.322 . . . . 72.340000000000003 111.871 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.495 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 96.6 mmm -56.56 -53.09 61.56 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.997 0.427 . . . . 74.299999999999997 111.335 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.528 ' HA ' HG22 ' A' ' 33' ' ' VAL . 60.9 mt -61.39 -41.07 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.243 0.544 . . . . 74.120000000000005 110.809 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.46 -36.6 64.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.594 -0.73 . . . . 75.209999999999994 111.995 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 21' ' ' GLU . 29.7 mm-40 -74.26 -54.18 8.24 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.997 0.427 . . . . 75.129999999999995 111.663 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.2 75.44 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.737 1.014 . . . . 73.140000000000001 113.737 -171.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -56.95 -27.81 61.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.232 0.827 . . . . 74.219999999999999 113.232 -174.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.06 -25.91 66.49 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.724 0.297 . . . . 73.319999999999993 111.688 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -107.88 -175.37 2.76 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.021 0.439 . . . . 73.439999999999998 111.802 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.38 33.5 0.35 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.005 0.431 . . . . 72.049999999999997 111.941 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.73 161.83 12.89 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.264 -0.493 . . . . 73.409999999999997 113.819 -175.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.7 m -132.22 135.96 46.67 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.463 0.305 . . . . 62.049999999999997 110.71 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.528 HG22 ' HA ' ' A' ' 23' ' ' ILE . 95.0 t -98.25 113.86 34.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.044 0.45 . . . . 72.319999999999993 112.15 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 t -107.91 141.51 39.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.209 -0.45 . . . . 74.420000000000002 110.225 173.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.453 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 40.1 p90 -150.53 152.01 33.52 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.984 0.421 . . . . 74.230000000000004 112.094 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.3 t -132.36 138.58 47.79 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.078 -0.51 . . . . 75.540000000000006 111.5 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.18 140.35 37.47 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.918 0.389 . . . . 73.430000000000007 112.037 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.32 99.97 2.4 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 110.93 171.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.94 -95.13 0.06 OUTLIER Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.272 -0.49 . . . . 51.549999999999997 113.392 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.428 HD21 ' HG3' ' A' ' 8' ' ' ARG . 3.1 p-10 -111.31 4.65 19.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.062 0.393 . . . . 74.230000000000004 112.062 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -108.47 137.68 46.03 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.321 0.582 . . . . 73.219999999999999 112.477 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 tp -134.3 99.46 4.39 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.36 -0.836 . . . . 73.329999999999998 110.452 176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.515 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 31.7 mt-10 -93.0 115.97 28.62 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.162 -0.337 . . . . 73.400000000000006 111.217 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 74.1 mt -114.11 109.93 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 116.243 -0.435 . . . . 75.439999999999998 111.907 -176.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -106.53 132.13 52.89 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.002 -0.436 . . . . 73.239999999999995 111.354 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.516 HG12 HG21 ' A' ' 33' ' ' VAL . 45.8 mt -107.63 114.35 46.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.082 0.468 . . . . 74.140000000000001 110.805 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.7 m -101.61 122.35 43.7 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.272 -0.422 . . . . 74.219999999999999 111.846 -178.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.85 49.6 1.15 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.251 -0.5 . . . . 61.340000000000003 114.335 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.3 m -122.81 144.91 43.96 Favored Pre-proline 0 N--CA 1.472 0.65 0 O-C-N 122.233 -0.569 . . . . 71.519999999999996 112.269 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.39 160.06 39.28 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.03 2.487 . . . . 74.230000000000004 112.109 172.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -62.39 -36.94 83.89 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.994 -0.441 . . . . 72.409999999999997 111.955 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -61.11 -19.99 62.12 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.122 0.487 . . . . 75.310000000000002 111.183 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.75 -36.5 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 116.063 -0.517 . . . . 62.210000000000001 110.889 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.773 ' HD2' ' SD ' ' A' ' 1' ' ' MET . 31.4 ttt180 -45.55 -53.08 9.52 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.242 0.544 . . . . 71.430000000000007 111.528 173.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -58.77 -34.12 71.07 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.915 -0.584 . . . . 74.040000000000006 111.674 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -75.54 -35.26 60.72 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.285 -0.416 . . . . 72.129999999999995 111.428 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.84 -45.04 94.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.076 0.465 . . . . 74.510000000000005 110.849 176.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 62' ' ' GLU . . . -60.76 -50.42 73.55 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.149 -0.478 . . . . 71.040000000000006 111.159 175.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -55.17 -36.8 66.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.156 -0.475 . . . . 71.409999999999997 112.21 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -75.12 -43.89 50.2 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.975 0.417 . . . . 71.010000000000005 111.112 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.06 -38.05 78.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.755 0.312 . . . . 61.229999999999997 111.78 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 7.1 mm-40 -53.38 -46.34 69.61 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.971 0.415 . . . . 74.299999999999997 111.047 175.928 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ttm-85 -61.67 -50.93 70.52 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.965 0.412 . . . . 75.349999999999994 110.694 178.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.83 -43.88 66.32 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.908 -0.587 . . . . 73.430000000000007 111.778 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . 0.452 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -66.18 -57.32 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.012 0.434 . . . . 71.329999999999998 111.981 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -62.67 -43.07 99.75 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.43 0.53 . . . . 75.209999999999994 112.43 -175.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.43 -36.86 83.71 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.804 -174.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.33 7.69 31.38 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.844 0.313 . . . . 72.099999999999994 111.844 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 58.38 27.69 15.74 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.028 0.442 . . . . 65.109999999999999 112.01 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.452 HG13 ' HA ' ' A' ' 65' ' ' ALA . 24.5 pt -96.25 154.84 3.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 121.056 0.455 . . . . 73.329999999999998 111.062 178.402 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.523 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 45.8 p -88.31 143.14 27.2 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.959 0.409 . . . . 72.439999999999998 111.88 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 12.1 p -141.88 135.6 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.18 0.514 . . . . 75.25 112.172 -177.356 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.7 p -128.75 143.22 50.87 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.371 -0.377 . . . . 72.340000000000003 110.014 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 21.0 p90 -131.35 115.33 16.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.394 0.616 . . . . 73.450000000000003 112.279 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 96.6 m -104.19 124.93 50.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.729 -0.669 . . . . 74.219999999999999 110.418 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.54 HG12 ' HG3' ' A' ' 3' ' ' MET . 44.3 mt -118.64 139.81 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.131 0.491 . . . . 73.530000000000001 112.237 -174.584 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.403 HH21 ' CD ' ' A' ' 2' ' ' GLU . 18.8 ptt180 -126.43 131.23 51.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.117 -0.492 . . . . 62.549999999999997 110.636 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.1 pp -134.85 168.76 18.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.697 0.628 . . . . 72.400000000000006 112.697 -173.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.75 85.64 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.937 -0.574 . . . . 75.150000000000006 111.913 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -72.69 126.01 28.87 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.915 0.388 . . . . 75.030000000000001 111.088 177.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -78.32 151.29 33.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.199 0.523 . . . . 74.310000000000002 112.33 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -104.35 106.74 17.35 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.811 -0.631 . . . . 72.319999999999993 111.071 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -111.94 -75.42 0.61 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.649 0.611 . . . . 75.219999999999999 112.649 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 62.49 35.71 14.5 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.205 0.526 . . . . 63.420000000000002 111.287 -173.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 37.9 m80 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.769 -0.634 . . . . 73.239999999999995 111.284 178.513 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.696 ' SD ' ' HD3' ' A' ' 54' ' ' ARG . 47.5 ttp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.715 0.293 . . . . 75.540000000000006 111.144 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.507 ' CD ' HH21 ' A' ' 45' ' ' ARG . 40.4 mt-10 -132.31 142.41 49.35 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.966 0.412 . . . . 75.519999999999996 111.36 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.505 ' HE2' HD12 ' A' ' 5' ' ' ILE . 21.1 ptm -133.06 118.63 18.99 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.289 0.566 . . . . 75.430000000000007 111.294 178.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -100.73 114.43 28.19 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.744 -0.662 . . . . 72.099999999999994 110.814 -178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.505 HD12 ' HE2' ' A' ' 3' ' ' MET . 45.1 mt -106.39 120.42 57.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.264 0.554 . . . . 74.409999999999997 111.365 -178.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -103.7 105.32 15.51 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.067 -0.515 . . . . 73.120000000000005 111.747 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -93.56 146.98 23.4 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.156 0.503 . . . . 74.230000000000004 111.974 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -143.03 120.78 11.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.304 -0.407 . . . . 71.150000000000006 110.674 171.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.65 156.52 28.23 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.776 -0.726 . . . . 63.520000000000003 112.94 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -89.1 -30.15 18.86 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.807 0.336 . . . . 74.230000000000004 111.412 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.9 120.53 13.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.948 0.404 . . . . 65.230000000000004 111.793 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.417 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 48.1 tp -63.75 -41.27 98.04 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.993 0.425 . . . . 73.219999999999999 111.316 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.09 -36.8 71.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.088 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -40.56 83.53 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.332 -0.395 . . . . 75.409999999999997 111.423 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.427 ' HE1' HD23 ' A' ' 37' ' ' LEU . 15.3 t80 -53.72 -58.68 6.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.193 -0.458 . . . . 72.340000000000003 111.74 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.69 -40.58 72.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.001 0.371 . . . . 72.219999999999999 112.001 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 67.9 mmtt -62.98 -46.7 86.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.393 0.516 . . . . 74.409999999999997 112.393 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.542 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.83 -49.05 79.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.902 0.382 . . . . 61.310000000000002 111.104 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -61.24 -41.02 96.17 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.128 0.489 . . . . 65.310000000000002 111.177 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -58.99 -54.86 42.42 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.768 -0.651 . . . . 74.329999999999998 111.802 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.99 -42.47 97.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.209 0.448 . . . . 73.120000000000005 112.209 -176.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.542 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 85.3 mmm -57.66 -48.57 79.13 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.119 -0.363 . . . . 73.299999999999997 111.148 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.499 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 63.0 mt -66.47 -38.44 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.212 0.53 . . . . 74.510000000000005 110.863 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.633 -0.712 . . . . 71.549999999999997 111.624 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -73.89 -40.92 62.83 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.641 0.258 . . . . 73.439999999999998 111.58 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.13 -29.97 64.03 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.856 0.687 . . . . 74.420000000000002 112.856 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.499 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.5 mtp180 -56.77 -29.57 62.77 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.378 0.51 . . . . 74.239999999999995 112.378 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.689 ' HB3' ' HZ3' ' A' ' 28' ' ' LYS . 3.5 mmmp? -75.26 -13.27 60.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.038 0.447 . . . . 72.239999999999995 111.715 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -120.54 178.73 4.56 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.07 0.462 . . . . 74.530000000000001 111.281 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.99 38.0 0.33 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.193 0.52 . . . . 72.239999999999995 111.505 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.35 124.64 7.68 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 114.345 0.498 . . . . 71.409999999999997 114.345 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -101.38 117.76 35.6 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.691 0.396 . . . . 65.450000000000003 109.997 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.413 HG22 HG12 ' A' ' 46' ' ' ILE . 49.0 t -108.13 130.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 120.956 0.408 . . . . 74.230000000000004 112.047 -176.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -132.74 161.2 34.65 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.296 -0.411 . . . . 74.530000000000001 110.972 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 28.4 p90 -151.36 152.76 33.57 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.575 0.583 . . . . 74.409999999999997 112.575 -175.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 t -137.15 134.69 36.64 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.815 -0.63 . . . . 74.420000000000002 111.045 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.427 HD23 ' HE1' ' A' ' 15' ' ' PHE . 4.2 mm? -99.36 139.96 34.24 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.246 0.546 . . . . 73.400000000000006 112.3 -178.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -142.89 86.0 1.91 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.971 -0.558 . . . . 75.299999999999997 110.529 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.56 -89.76 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 121.367 -0.444 . . . . 70.129999999999995 113.481 -178.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -95.44 -25.76 16.12 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.691 0.397 . . . . 71.25 111.781 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -93.16 147.22 23.07 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.539 0.685 . . . . 75.219999999999999 112.659 -171.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 43.3 tp -134.95 104.33 5.93 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.158 -0.928 . . . . 71.140000000000001 110.192 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.461 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.3 tt0 -94.35 111.08 22.8 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.701 0.286 . . . . 73.420000000000002 111.107 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 65.8 mt -112.78 109.85 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-N 116.435 -0.348 . . . . 73.019999999999996 111.341 -179.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.507 HH21 ' CD ' ' A' ' 2' ' ' GLU . 61.8 ttt180 -104.64 120.01 40.33 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.981 0.419 . . . . 74.540000000000006 111.145 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.413 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -106.95 125.89 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.936 0.398 . . . . 75.329999999999998 111.299 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' THR . . . . . 0.45 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -121.34 136.59 54.94 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.346 -0.388 . . . . 63.25 111.762 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.19 -13.94 40.24 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.755 -0.736 . . . . 71.239999999999995 114.193 174.394 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.35 138.1 95.72 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 117.268 0.534 . . . . 75.349999999999994 111.837 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.453 ' HG2' HG23 ' A' ' 53' ' ' VAL . 42.7 Cg_endo -68.8 152.6 73.91 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.382 2.055 . . . . 72.140000000000001 113.361 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -45.24 -43.11 10.12 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.836 1.05 . . . . 75.310000000000002 113.836 -176.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.21 -37.66 87.99 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.642 0.608 . . . . 70.400000000000006 112.642 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.524 HG13 ' HG ' ' A' ' 57' ' ' LEU . 57.6 t -73.89 -23.51 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.025 0.441 . . . . 74.200000000000003 111.708 -177.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.696 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 42.8 ttp180 -46.68 -50.52 17.71 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.334 0.588 . . . . 74.040000000000006 111.708 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . 0.414 ' CB ' ' HZ1' ' A' ' 55' ' ' LYS . 7.1 mtpm? -59.27 -44.77 92.42 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.244 -0.889 . . . . 73.420000000000002 112.029 179.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -68.95 -48.42 63.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.038 -0.528 . . . . 64.519999999999996 111.67 -175.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.524 ' HG ' HG13 ' A' ' 53' ' ' VAL . 87.1 mt -59.66 -33.85 72.08 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.555 0.217 . . . . 73.120000000000005 111.524 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.194 0.521 . . . . 61.310000000000002 110.594 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 ttpp -57.45 -45.46 84.73 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.752 -0.658 . . . . 74.450000000000003 111.226 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.98 95.67 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.49 -0.323 . . . . 74.340000000000003 111.79 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.37 -42.55 87.26 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.102 0.477 . . . . 75.230000000000004 111.291 177.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.29 -42.4 93.17 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.222 -0.444 . . . . 74.239999999999995 111.336 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -64.92 -37.96 89.37 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.734 0.302 . . . . 75.209999999999994 111.139 177.332 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.8 mt -57.38 -43.22 83.41 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.947 0.404 . . . . 72.319999999999993 110.65 172.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.98 -51.52 69.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.072 -0.513 . . . . 74.349999999999994 111.776 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -67.79 -26.24 65.99 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.222 0.453 . . . . 72.030000000000001 112.222 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.94 -50.56 72.97 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.949 0.404 . . . . 64.409999999999997 111.63 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -108.54 7.27 26.69 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.17 0.433 . . . . 74.200000000000003 112.17 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.8 t30 58.57 66.61 1.05 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.321 0.581 . . . . 74.430000000000007 111.356 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.8 pt -130.46 172.23 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 116.17 -0.468 . . . . 70.129999999999995 111.23 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.7 m -96.34 135.68 37.85 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.585 -0.279 . . . . 74.230000000000004 111.324 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.29 138.76 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.171 0.51 . . . . 75.230000000000004 112.118 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.6 p -127.43 172.87 10.28 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.999 -0.546 . . . . 63.32 109.742 172.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -145.92 115.77 7.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.364 0.602 . . . . 71.150000000000006 112.451 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 97.4 m -93.18 104.54 16.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.689 -0.687 . . . . 64.319999999999993 110.139 173.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.485 HG21 ' HD2' ' A' ' 54' ' ' ARG . 52.8 mt -111.93 129.42 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.947 0.403 . . . . 74.400000000000006 111.811 -175.533 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -100.25 106.65 18.33 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.177 0.513 . . . . 65.340000000000003 111.086 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -142.51 110.66 5.99 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.915 -0.584 . . . . 72.219999999999999 109.692 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HB2' ' HD2' ' A' ' 81' ' ' HIS . 8.8 pt-20 -73.85 148.98 41.87 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.304 0.573 . . . . 75.439999999999998 112.538 -176.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -127.77 80.72 1.98 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.914 -0.584 . . . . 75.230000000000004 110.754 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . 0.437 ' HD2' ' HB2' ' A' ' 79' ' ' GLU . 31.3 m-70 -98.36 102.45 14.19 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.307 0.575 . . . . 75.510000000000005 112.015 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -146.99 173.47 12.41 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.653 -0.703 . . . . 73.299999999999997 110.258 176.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -136.38 15.21 3.21 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.178 0.513 . . . . 72.019999999999996 110.9 176.411 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -155.61 2.99 0.18 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 116.105 -0.498 . . . . 73.120000000000005 111.876 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 84.7 t60 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.998 -0.525 . . . . 70.109999999999999 111.61 -179.104 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.944 0.402 . . . . 73.530000000000001 111.358 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -115.11 148.02 39.49 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.244 -0.435 . . . . 74.409999999999997 110.949 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.504 ' HG3' HG12 ' A' ' 76' ' ' ILE . 27.1 ttt -130.6 107.69 9.37 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.182 0.515 . . . . 75.540000000000006 111.663 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.502 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 2.9 m-20 -81.91 104.6 12.39 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.875 -0.602 . . . . 72.129999999999995 111.158 176.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.7 mt -107.74 109.41 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 120.99 0.424 . . . . 70.239999999999995 111.281 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.73 107.06 18.16 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.568 -0.287 . . . . 73.140000000000001 111.549 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.03 138.56 31.3 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.553 -0.294 . . . . 74.109999999999999 110.226 172.223 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -137.54 120.29 16.28 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.806 0.336 . . . . 73.239999999999995 110.615 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.4 149.53 16.08 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.053 -0.594 . . . . 55.340000000000003 112.938 -178.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.04 23.67 1.72 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 120.831 0.348 . . . . 63.310000000000002 111.648 -178.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -119.53 120.84 37.92 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 120.888 0.375 . . . . 72.420000000000002 111.393 -175.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 49.9 tp -72.23 -38.25 68.98 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.153 0.427 . . . . 71.329999999999998 112.153 -176.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.45 -40.4 93.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.88 0.372 . . . . 74.340000000000003 111.221 178.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.4 -43.32 83.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.164 -0.471 . . . . 72.230000000000004 111.156 175.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.541 ' HE1' HD12 ' A' ' 42' ' ' LEU . 56.6 t80 -50.03 -55.31 15.28 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.684 -0.689 . . . . 75.209999999999994 111.577 176.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.64 -56.28 19.22 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.975 0.361 . . . . 73.129999999999995 111.975 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -61.97 -49.29 76.7 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.674 0.62 . . . . 71.239999999999995 112.674 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.405 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.46 -48.38 82.03 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.974 0.416 . . . . 74.439999999999998 111.574 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.9 tp -62.76 -43.39 98.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.045 0.45 . . . . 74.25 111.473 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -57.95 -47.85 81.68 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.88 -0.6 . . . . 75.140000000000001 111.763 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -66.66 -33.15 75.01 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.372 0.508 . . . . 72.040000000000006 112.372 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.405 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.4 mmm -66.07 -47.61 73.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.976 0.417 . . . . 73.420000000000002 110.895 176.435 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.71 -39.55 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 116.282 -0.417 . . . . 72.239999999999995 111.033 177.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.0 ttm-85 -54.58 -45.45 73.56 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.138 0.494 . . . . 73.040000000000006 111.204 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -72.45 -45.92 57.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.235 -0.439 . . . . 64.430000000000007 111.548 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.82 -34.96 70.22 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.245 0.461 . . . . 72.120000000000005 112.245 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -58.44 -28.72 65.55 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.043 0.386 . . . . 75.409999999999997 112.043 177.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -66.21 -33.66 76.26 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.13 0.491 . . . . 74.409999999999997 111.228 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -96.54 -178.03 4.13 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.216 -0.447 . . . . 75.439999999999998 111.425 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.18 4.12 43.71 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.21 0.448 . . . . 72.129999999999995 112.21 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.91 159.62 42.02 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.186 -0.53 . . . . 50.32 113.812 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.7 m -119.1 144.49 46.58 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 122.609 -0.348 . . . . 73.310000000000002 110.767 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.405 HG21 HG12 ' A' ' 46' ' ' ILE . 64.5 t -117.7 124.43 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 112.036 0.384 . . . . 71.420000000000002 112.036 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -118.31 148.69 42.22 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.441 -0.345 . . . . 63.43 110.483 172.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -150.71 138.25 19.66 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.483 . . . . 74.0 112.138 -177.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.2 p -123.88 119.78 30.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.09 -0.504 . . . . 65.0 110.808 176.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.4 tp -93.73 101.47 13.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.119 0.485 . . . . 74.140000000000001 111.629 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -99.04 96.88 8.1 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.122 -0.49 . . . . 74.219999999999999 110.773 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.64 -90.33 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.3 -0.476 . . . . 64.140000000000001 113.154 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -119.6 -1.04 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.855 0.36 . . . . 73.5 111.11 179.354 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.15 121.81 44.59 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.273 -0.421 . . . . 75.400000000000006 111.396 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.541 HD12 ' HE1' ' A' ' 15' ' ' PHE . 64.6 tp -104.02 99.67 9.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.177 0.513 . . . . 73.420000000000002 110.659 176.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -85.28 104.52 15.2 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.215 -0.448 . . . . 72.340000000000003 111.197 179.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.5 mt -103.48 136.41 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.346 -0.388 . . . . 74.109999999999999 111.395 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -125.39 115.6 20.55 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.943 0.401 . . . . 73.019999999999996 110.771 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.405 HG12 HG21 ' A' ' 33' ' ' VAL . 51.6 mt -101.64 115.3 43.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.036 0.446 . . . . 74.209999999999994 110.689 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.9 m -101.43 123.68 45.88 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.284 -0.416 . . . . 74.129999999999995 111.6 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.22 65.01 1.22 Allowed Glycine 0 CA--C 1.527 0.798 0 C-N-CA 121.091 -0.576 . . . . 73.109999999999999 113.46 176.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.6 m -113.85 133.87 22.2 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 122.551 -0.382 . . . . 71.120000000000005 111.923 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.445 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 37.5 Cg_endo -65.57 125.78 14.98 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.578 2.186 . . . . 73.319999999999993 112.837 178.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -54.7 -34.44 62.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.483 0.549 . . . . 75.430000000000007 112.483 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.498 ' HG3' HG22 ' A' ' 53' ' ' VAL . 13.7 pt20 -63.92 -40.02 95.5 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.737 0.303 . . . . 65.310000000000002 111.763 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.498 HG22 ' HG3' ' A' ' 52' ' ' GLN . 58.4 t -86.75 -19.07 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.816 0.341 . . . . 74.239999999999995 111.498 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HD2' HD11 ' A' ' 76' ' ' ILE . 16.4 ttp180 -48.81 -36.35 16.55 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.287 0.477 . . . . 73.209999999999994 112.287 -178.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -61.42 -40.97 96.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.879 0.371 . . . . 71.230000000000004 111.481 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -69.84 -35.94 75.15 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.798 0.333 . . . . 70.450000000000003 111.042 177.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.44 -43.2 91.15 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.057 0.456 . . . . 75.439999999999998 110.853 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.53 94.43 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.243 0.544 . . . . 75.329999999999998 110.865 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.408 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 27.9 ttpt -59.64 -50.74 72.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.025 -0.534 . . . . 73.25 111.189 174.527 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -69.64 -37.8 76.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.94 -0.573 . . . . 71.019999999999996 111.713 -174.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.17 -51.82 55.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.042 0.449 . . . . 60.32 111.493 178.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.535 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 42.2 mt-10 -72.92 -31.49 64.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.484 -0.326 . . . . 64.319999999999993 111.357 176.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -48.67 78.33 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.882 0.372 . . . . 72.310000000000002 110.306 178.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.9 mt -52.79 -47.3 67.68 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.991 -0.549 . . . . 70.420000000000002 111.188 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.81 -42.06 83.46 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.051 -0.522 . . . . 75.540000000000006 111.874 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 62.1 mttm -68.64 -26.61 65.42 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.404 -0.362 . . . . 73.5 111.664 -178.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -68.55 -48.99 62.84 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.198 0.523 . . . . 72.329999999999998 111.198 174.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -96.14 1.33 52.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.487 0.551 . . . . 73.510000000000005 112.487 -175.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 61.72 26.17 15.88 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.084 0.401 . . . . 71.329999999999998 112.084 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -103.65 175.58 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 121.215 0.531 . . . . 75.519999999999996 112.425 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.8 m -97.3 139.73 32.83 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 116.181 -0.463 . . . . 75.140000000000001 112.042 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -146.37 137.28 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.978 0.418 . . . . 73.109999999999999 111.663 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.4 p -128.66 139.11 52.41 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 116.664 -0.244 . . . . 74.25 110.594 175.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . 0.502 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 43.5 p90 -127.27 119.38 26.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.363 0.601 . . . . 74.439999999999998 112.476 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 71.7 m -103.55 139.81 38.37 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.733 -0.667 . . . . 75.239999999999995 109.714 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.504 HG12 ' HG3' ' A' ' 3' ' ' MET . 56.3 mt -131.15 128.49 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 121.864 -0.522 . . . . 75.140000000000001 112.408 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -85.82 105.69 16.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.884 -0.413 . . . . 75.439999999999998 109.884 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -100.8 124.86 47.07 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.118 0.485 . . . . 75.430000000000007 111.174 -174.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -91.17 104.77 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.936 -0.574 . . . . 74.420000000000002 110.976 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -124.25 143.13 50.72 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.011 0.434 . . . . 62.149999999999999 111.851 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -86.16 137.45 32.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.276 -0.42 . . . . 70.530000000000001 111.082 177.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.9 t60 -144.5 105.37 4.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.605 0.24 . . . . 71.230000000000004 111.344 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -80.41 151.22 29.48 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.232 0.539 . . . . 74.230000000000004 111.942 178.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -149.09 136.65 20.31 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.876 -0.602 . . . . 72.430000000000007 111.052 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.708 -0.663 . . . . 72.329999999999998 111.403 178.931 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.513 ' HE1' HG22 ' A' ' 49' ' ' VAL . 55.4 ttp . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 120.994 0.426 . . . . 72.150000000000006 111.532 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.07 146.3 51.06 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.573 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.464 ' HE2' HD12 ' A' ' 5' ' ' ILE . 21.0 ptm -131.65 121.95 25.15 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.9 0.704 . . . . 75.25 112.9 -175.223 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.552 ' HB3' ' NH1' ' A' ' 6' ' ' ARG . 3.8 m-20 -86.01 134.9 33.83 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.868 -0.605 . . . . 74.209999999999994 111.545 173.476 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.464 HD12 ' HE2' ' A' ' 3' ' ' MET . 59.3 mt -139.24 133.24 39.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.101 0.56 . . . . 73.329999999999998 110.055 173.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 0.552 ' NH1' ' HB3' ' A' ' 4' ' ' ASP . 49.9 mtt85 -132.84 113.23 12.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.974 0.416 . . . . 72.319999999999993 112.02 -175.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.519 ' HE1' ' SD ' ' A' ' 22' ' ' MET . 97.0 m-85 -93.25 142.55 27.19 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.305 -0.407 . . . . 70.530000000000001 110.9 177.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.1 ttt180 -142.37 127.13 18.12 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.536 0.208 . . . . 71.200000000000003 111.514 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.486 ' HA3' HG23 ' A' ' 70' ' ' ILE . . . -170.27 -175.37 39.07 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 120.842 -0.694 . . . . 74.120000000000005 113.948 -178.348 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -95.2 -50.88 4.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.986 0.365 . . . . 74.109999999999999 111.986 -176.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -61.36 114.48 3.22 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.9 0.381 . . . . 73.109999999999999 111.049 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.55 -50.42 73.86 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.645 0.609 . . . . 74.099999999999994 112.645 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.401 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 22.0 mt-10 -56.23 -25.42 47.43 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.855 0.687 . . . . 72.540000000000006 112.855 -178.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.08 -34.02 59.08 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.754 0.311 . . . . 74.319999999999993 111.608 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.488 ' HB3' HD22 ' A' ' 42' ' ' LEU . 78.6 m-85 -72.05 -60.2 2.35 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.505 -0.316 . . . . 74.519999999999996 111.476 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 10.9 pt-20 -57.67 -40.67 79.9 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.122 0.416 . . . . 73.340000000000003 112.122 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -70.21 -42.45 72.32 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.1 0.407 . . . . 74.010000000000005 112.1 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -46.72 82.48 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.211 0.529 . . . . 73.310000000000002 110.415 174.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.416 ' HB2' HD23 ' A' ' 42' ' ' LEU . 64.3 tp -56.05 -43.57 78.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.69 -0.686 . . . . 72.099999999999994 111.247 175.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -56.14 -46.11 79.36 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.062 -0.517 . . . . 74.409999999999997 111.498 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -65.99 -40.26 91.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.714 0.292 . . . . 73.530000000000001 111.677 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' MET . . . . . 0.519 ' SD ' ' HE1' ' A' ' 7' ' ' PHE . 80.8 mtp -61.37 -53.29 58.52 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.72 0.295 . . . . 74.019999999999996 111.202 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.604 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 69.1 mt -59.49 -42.31 87.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-O 120.931 0.396 . . . . 74.010000000000005 110.506 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -48.41 -50.34 31.4 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.948 -0.569 . . . . 65.310000000000002 111.562 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -75.14 -33.02 61.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.913 0.387 . . . . 71.230000000000004 111.663 178.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -31.9 73.27 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.384 0.512 . . . . 61.350000000000001 112.384 -178.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.604 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 43.3 mtp180 -63.91 -27.84 69.42 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.93 0.395 . . . . 73.519999999999996 111.333 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -57.13 -25.03 58.17 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.136 -0.484 . . . . 75.219999999999999 111.486 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -120.16 167.74 11.92 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.988 0.423 . . . . 75.340000000000003 110.999 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.13 87.27 7.15 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.469 . . . . 74.209999999999994 110.748 176.6 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -146.42 157.68 27.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.836 -0.697 . . . . 73.310000000000002 113.474 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.9 m -106.98 128.81 54.68 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 122.793 -0.24 . . . . 74.109999999999999 111.276 -179.518 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -110.6 109.38 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 120.77 0.319 . . . . 73.230000000000004 111.33 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.6 p -101.06 130.46 47.09 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.392 0.277 . . . . 72.209999999999994 110.286 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.52 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 47.5 p90 -144.01 150.2 37.88 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.66 0.615 . . . . 71.549999999999997 112.66 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -139.28 133.59 31.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.993 -0.548 . . . . 71.430000000000007 111.398 171.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.8 tp -95.28 106.33 18.35 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.018 0.437 . . . . 71.010000000000005 110.483 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -126.82 118.23 24.22 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.023 0.44 . . . . 71.430000000000007 111.411 -172.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.04 -101.4 0.6 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.338 -0.458 . . . . 74.400000000000006 113.049 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -122.1 6.1 9.77 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 71.430000000000007 111.089 176.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.82 139.51 49.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.357 0.598 . . . . 71.329999999999998 112.067 -176.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.488 HD22 ' HB3' ' A' ' 15' ' ' PHE . 64.7 tp -108.02 101.72 10.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.102 -0.499 . . . . 74.329999999999998 109.84 172.065 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 7.9 tm-20 -81.52 115.04 20.64 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.925 -0.58 . . . . 74.510000000000005 110.556 -177.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -123.86 129.44 74.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 120.788 0.327 . . . . 74.209999999999994 111.616 -177.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -126.43 127.5 45.52 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 122.129 -0.357 . . . . 74.340000000000003 111.024 174.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.3 mt -111.89 124.22 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-O 120.976 0.417 . . . . 74.230000000000004 111.122 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -105.63 130.72 53.6 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.178 -0.465 . . . . 65.450000000000003 111.953 -177.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.67 28.47 8.89 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.197 -0.525 . . . . 61.549999999999997 113.832 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.513 HG22 ' HE1' ' A' ' 1' ' ' MET . 13.7 m -89.63 134.72 31.81 Favored Pre-proline 0 CA--C 1.543 0.703 0 O-C-N 122.41 -0.465 . . . . 71.319999999999993 111.974 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 8.1 Cg_exo -74.9 144.77 31.04 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.862 2.375 . . . . 62.100000000000001 113.023 177.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 3.1 tm-20 -53.2 -48.43 68.11 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 120.98 0.419 . . . . 72.340000000000003 111.28 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.421 ' HG3' HG23 ' A' ' 53' ' ' VAL . 20.6 pt20 -56.13 -28.63 58.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.367 0.506 . . . . 74.120000000000005 112.367 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.421 HG23 ' HG3' ' A' ' 52' ' ' GLN . 46.4 t -94.92 -22.87 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.965 0.412 . . . . 74.329999999999998 111.262 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.428 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 23.2 ttp180 -50.84 -49.4 58.94 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.142 0.496 . . . . 74.540000000000006 111.598 179.575 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -54.77 -40.84 69.79 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.573 -0.74 . . . . 75.319999999999993 111.968 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.5 -44.87 66.75 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.437 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.406 ' HG ' HG12 ' A' ' 53' ' ' VAL . 94.4 mt -63.98 -42.96 97.06 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.773 0.32 . . . . 73.310000000000002 111.77 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.95 -50.04 72.36 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.894 0.378 . . . . 65.519999999999996 111.136 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.416 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 2.7 tmmm? -56.72 -47.55 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.135 -0.484 . . . . 74.510000000000005 110.531 175.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.49 -40.63 87.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.155 -0.475 . . . . 72.129999999999995 110.96 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.41 -46.26 86.79 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.929 0.395 . . . . 71.329999999999998 111.488 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.67 -41.61 95.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.069 0.461 . . . . 62.439999999999998 111.049 176.553 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.66 -42.03 98.14 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.356 -0.384 . . . . 71.400000000000006 111.289 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.25 -48.31 79.19 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.997 0.427 . . . . 74.25 111.179 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.53 -55.63 23.89 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.011 -0.54 . . . . 71.340000000000003 111.321 177.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -60.25 -35.47 75.55 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.228 -0.442 . . . . 72.099999999999994 111.975 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.96 -46.53 88.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.138 0.494 . . . . 74.129999999999995 111.397 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.18 7.58 43.68 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.488 -0.324 . . . . 75.420000000000002 111.783 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t30 58.82 32.93 22.71 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.583 0.706 . . . . 73.540000000000006 111.058 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.486 HG23 ' HA3' ' A' ' 9' ' ' GLY . 20.3 pt -111.78 164.09 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 116.178 -0.464 . . . . 74.040000000000006 111.512 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 53.9 m -94.98 134.67 37.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.382 -0.372 . . . . 64.239999999999995 111.039 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.7 p -122.96 135.8 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 121.27 0.557 . . . . 74.319999999999993 112.202 -179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.6 p -128.84 141.34 51.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.053 -0.521 . . . . 73.439999999999998 110.008 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -139.72 160.87 38.9 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.608 0.596 . . . . 65.549999999999997 112.608 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.1 m -149.93 109.67 4.06 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.785 -0.643 . . . . 75.349999999999994 110.154 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -106.09 127.95 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 112.148 0.425 . . . . 74.150000000000006 112.148 -174.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.428 ' O ' ' HG3' ' A' ' 1' ' ' MET . 45.9 mtt180 -107.96 116.47 32.02 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 111.125 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tt -117.78 125.23 50.23 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.882 0.373 . . . . 75.219999999999999 110.433 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.42 ' HB3' ' NE2' ' A' ' 82' ' ' HIS . 9.8 mp0 -71.84 96.13 1.62 Allowed 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.918 0.389 . . . . 62.140000000000001 111.191 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -81.01 166.14 21.07 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.561 0.578 . . . . 75.349999999999994 112.561 -175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.9 m170 68.81 9.63 7.47 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.547 0.739 . . . . 75.120000000000005 112.894 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' HIS . . . . . 0.42 ' NE2' ' HB3' ' A' ' 79' ' ' GLU . 6.0 m170 -73.47 99.17 2.93 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.36 0.504 . . . . 72.239999999999995 112.36 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -170.15 141.17 2.06 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.649 -0.705 . . . . 70.409999999999997 110.252 177.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -69.41 92.61 0.61 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.352 0.596 . . . . 75.349999999999994 110.922 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 20.3 p80 . . . . . 0 C--O 1.253 1.261 0 CA-C-N 115.474 -0.785 . . . . 71.329999999999998 112.559 -175.536 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.4 ' HE3' HG23 ' A' ' 49' ' ' VAL . 59.0 ttp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.809 0.338 . . . . 75.25 110.761 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.428 ' HG3' ' HA ' ' A' ' 47' ' ' THR . 4.5 mp0 -104.75 165.9 10.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.349 -0.387 . . . . 72.25 110.721 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.401 ' HG3' HD13 ' A' ' 76' ' ' ILE . 27.4 ttt -143.83 117.34 9.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.108 -0.37 . . . . 70.22 111.804 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 20.9 m-20 -94.62 103.85 15.79 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.812 0.339 . . . . 71.44 111.188 176.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.43 108.89 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.893 0.377 . . . . 71.23 110.563 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 58.0 mtp180 -99.94 107.21 19.12 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.604 -0.271 . . . . 64.52 111.497 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -90.35 126.58 35.92 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.796 0.331 . . . . 65.35 111.161 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 73.8 ttt-85 -127.06 120.12 28.22 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 110.067 -0.346 . . . . 74.55 110.067 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -142.57 -170.73 12.89 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 120.653 -0.784 . . . . 74.42 113.853 -172.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -103.9 -47.06 4.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.561 0.578 . . . . 72.41 112.561 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -100.83 152.79 20.1 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.961 -0.462 . . . . 73.43 111.688 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.97 -36.66 85.11 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.175 0.435 . . . . 72.44 112.175 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -58.53 -32.82 69.21 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.384 -0.371 . . . . 74.12 111.248 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.37 -45.48 80.5 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.063 0.459 . . . . 75.12 111.143 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -67.5 -47.05 71.12 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.142 0.496 . . . . 75.13 110.792 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -54.41 -57.94 9.37 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.723 -0.671 . . . . 71.42 112.14 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -65.33 -47.82 75.18 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.272 -0.422 . . . . 75.31 111.6 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.7 -51.2 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.403 . . . . 73.14 111.582 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.23 -45.06 88.39 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.139 0.495 . . . . 72.12 111.447 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -67.31 -31.73 72.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.141 -0.481 . . . . 63.32 111.752 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 27.0 mm-40 -70.18 -39.16 75.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.762 0.315 . . . . 73.31 111.444 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 90.5 mmm -59.93 -52.45 65.38 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.543 -0.299 . . . . 75.54 110.532 174.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.481 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 72.5 mt -58.02 -40.45 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.139 0.495 . . . . 70.14 111.209 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 68.9 ttt180 -48.52 -58.73 4.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.689 -0.687 . . . . 73.54 111.824 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -75.73 -39.22 57.63 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.41 0.522 . . . . 73.54 112.41 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.2 -30.03 59.11 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.563 0.579 . . . . 74.41 112.563 -175.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 74.9 mtp180 -59.87 -28.99 68.01 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.081 0.4 . . . . 71.13 112.081 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.416 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 12.7 mptt -74.16 -14.9 61.02 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.678 0.275 . . . . 71.1 111.56 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -110.79 149.47 30.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.84 0.352 . . . . 72.12 111.016 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.08 58.17 1.94 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.281 0.562 . . . . 61.3 111.559 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -131.0 133.15 7.13 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 116.107 -0.497 . . . . 75.55 112.276 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.4 m -85.97 117.83 25.06 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.857 0.361 . . . . 63.51 111.627 -176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -92.31 109.59 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.229 0.538 . . . . 64.45 111.927 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.4 p -113.41 153.58 28.37 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.153 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -156.43 149.05 23.69 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.667 0.617 . . . . 73.4 112.667 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.1 p -130.29 126.57 37.57 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.637 -0.71 . . . . 70.21 110.811 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.1 tp -97.87 99.42 10.74 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.048 0.452 . . . . 72.31 110.926 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -106.18 106.66 17.28 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.967 0.413 . . . . 72.04 110.838 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 60.7 -112.92 5.03 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.12 -0.562 . . . . 63.33 112.335 -175.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 47.3 t-20 -115.67 72.3 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.03 0.443 . . . . 72.22 110.175 173.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -175.99 122.28 0.18 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.576 -0.738 . . . . 63.45 109.785 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.2 tp -104.74 101.14 10.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 72.01 111.047 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -85.09 104.45 15.01 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.472 -0.331 . . . . 75.2 111.095 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.9 mt -99.6 109.07 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 111.773 0.286 . . . . 74.41 111.773 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -98.87 106.23 18.47 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.185 0.517 . . . . 62.02 111.578 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.9 mt -91.8 112.01 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.298 174.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.428 ' HA ' ' HG3' ' A' ' 2' ' ' GLU . 91.7 m -93.04 120.44 33.34 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.218 -0.446 . . . . 44.01 112.0 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.87 65.13 1.09 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.434 -0.412 . . . . 72.41 113.922 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.4 HG23 ' HE3' ' A' ' 1' ' ' MET . 16.4 m -122.06 136.56 26.4 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 122.405 -0.468 . . . . 74.54 111.914 177.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -78.65 150.8 24.72 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.598 2.199 . . . . 73.14 112.461 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -60.06 -30.63 69.34 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.852 0.686 . . . . 64.23 112.852 -174.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG3' HG23 ' A' ' 53' ' ' VAL . 28.9 pt20 -63.58 -45.62 89.59 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.948 0.404 . . . . 74.42 111.308 177.566 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.462 HG23 ' HG3' ' A' ' 52' ' ' GLN . 61.3 t -77.08 -27.72 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.869 0.366 . . . . 63.54 111.109 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.2 ttp180 -48.94 -40.98 32.38 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.161 0.505 . . . . 71.43 111.193 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -60.91 -51.84 67.58 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.822 -0.626 . . . . 71.42 111.311 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -62.09 -44.65 96.19 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.828 -0.624 . . . . 75.33 112.097 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.31 -45.68 75.79 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.771 0.319 . . . . 71.41 111.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.91 94.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.059 0.457 . . . . 73.44 111.508 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -72.27 -34.89 68.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.156 -0.475 . . . . 65.23 112.064 -178.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -71.39 -31.99 67.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.262 -0.575 . . . . 65.21 110.566 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.09 -44.09 78.67 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.951 0.405 . . . . 72.3 110.498 171.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -58.1 -50.0 74.99 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.335 0.588 . . . . 52.35 110.43 172.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 63' ' ' ARG . 13.5 tpt180 -53.41 -48.77 68.4 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.347 -0.842 . . . . 72.33 111.475 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.73 -50.69 72.39 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.182 0.515 . . . . 44.04 111.046 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.39 65.69 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.09 -0.504 . . . . 44.44 111.868 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -74.38 -59.8 2.56 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 122.372 -0.205 . . . . 74.04 111.463 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -35.45 70.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.304 0.483 . . . . 72.31 112.304 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -92.79 -6.87 48.0 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.185 -0.322 . . . . 74.25 111.8 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.1 t30 57.93 15.83 3.34 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.395 0.617 . . . . 71.55 111.828 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.1 pt -87.1 174.88 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.051 0.453 . . . . 65.15 111.84 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.1 m -90.01 139.06 30.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.196 -0.456 . . . . 75.41 111.317 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.2 p -135.67 126.6 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.183 0.516 . . . . 73.25 111.472 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 71.8 p -129.64 120.53 25.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.419 -0.355 . . . . 44.12 110.333 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -121.22 117.79 27.97 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.063 0.459 . . . . 75.44 112.019 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.8 m -98.82 116.86 31.99 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.902 0.382 . . . . 74.53 111.037 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.401 HD13 ' HG3' ' A' ' 3' ' ' MET . 42.6 mm -82.0 112.37 19.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 116.446 -0.343 . . . . 44.14 111.041 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 77' ' ' ARG . 19.3 mmm180 . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 120.936 0.398 . . . . 72.52 110.552 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.411 ' HE2' ' HA ' ' A' ' 51' ' ' GLU . 75.3 mtm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.779 0.323 . . . . 74.03 111.468 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.585 ' HB2' ' HG3' ' A' ' 77' ' ' ARG . 39.8 mt-10 -124.32 163.09 22.42 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.281 0.563 . . . . 72.51 111.862 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.67 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 25.7 ttt -143.59 111.95 6.34 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.061 -0.518 . . . . 74.14 111.613 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.43 120.78 28.13 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.661 0.267 . . . . 71.32 111.043 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 44' ' ' ILE . 22.5 mt -124.64 147.64 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.876 0.37 . . . . 73.13 111.814 -174.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.05 110.37 8.44 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.429 -0.35 . . . . 74.51 110.987 170.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -89.28 124.18 34.17 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.825 -0.435 . . . . 71.24 109.825 172.057 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 58.2 ttt180 -124.24 125.44 44.4 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.024 0.44 . . . . 71.14 111.852 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 170.76 -168.12 41.24 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.846 -0.692 . . . . 43.31 113.608 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -123.07 90.17 3.24 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 122.666 0.386 . . . . 74.43 110.852 -179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -175.95 142.26 0.51 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.149 -0.478 . . . . 62.3 110.372 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 35.0 tp -89.28 -39.63 13.35 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 111.853 0.316 . . . . 73.42 111.853 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -66.66 -32.26 73.46 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 122.17 -0.331 . . . . 73.32 111.251 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.69 -41.91 70.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.057 0.456 . . . . 74.13 110.909 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.467 ' CD1' HD22 ' A' ' 42' ' ' LEU . 62.4 t80 -58.83 -56.74 18.27 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.797 -0.638 . . . . 63.54 111.502 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.08 -52.33 63.11 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.144 0.424 . . . . 71.41 112.144 -176.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -62.43 -54.59 38.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.763 0.653 . . . . 74.53 112.763 -176.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.46 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.15 -43.86 87.59 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.92 0.391 . . . . 75.23 111.558 -178.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.2 tp -66.81 -42.54 85.75 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.975 0.417 . . . . 72.53 111.327 177.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -59.33 -52.77 64.23 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.155 -0.475 . . . . 53.33 111.985 -177.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -60.93 -49.59 76.85 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.203 0.445 . . . . 74.21 112.203 -176.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 51.4 mtp -62.94 -40.81 98.78 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.739 0.274 . . . . 44.02 111.739 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.3 mt -64.16 -41.92 93.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 120.974 0.416 . . . . 62.42 110.624 174.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.3 -46.53 79.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.061 -0.518 . . . . 72.34 111.136 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' A' ' 28' ' ' LYS . 26.2 mt-30 -74.3 -36.11 63.72 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.308 0.484 . . . . 71.4 112.308 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.86 -47.1 87.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.934 -0.479 . . . . 73.31 111.618 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -59.63 -39.49 84.49 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.744 0.646 . . . . 72.45 112.744 -177.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 20.8 ptmt -69.37 -14.33 62.85 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.987 0.422 . . . . 75.13 111.372 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -108.43 15.18 24.15 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.445 -0.343 . . . . 73.0 111.119 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.88 16.81 10.63 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.532 0.567 . . . . 74.54 112.532 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -78.43 133.31 12.61 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 121.442 -0.409 . . . . 52.13 113.587 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.7 m -90.85 122.5 33.61 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.542 -0.387 . . . . 75.54 111.117 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG22 HG12 ' A' ' 46' ' ' ILE . 49.9 t -109.03 130.17 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 120.96 0.41 . . . . 70.22 111.871 -179.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.9 t -124.64 132.79 53.4 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.519 -0.309 . . . . 74.42 110.794 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.524 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.7 p90 -128.34 144.92 51.19 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.369 0.507 . . . . 73.21 112.369 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 37.8 p -137.84 133.24 33.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.96 -0.564 . . . . 72.24 111.13 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.55 115.44 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.747 0.308 . . . . 72.2 111.31 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -114.21 81.39 1.53 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.383 0.611 . . . . 65.23 111.496 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.72 -85.09 0.03 OUTLIER Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.814 0.685 . . . . 55.31 114.814 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -100.06 -10.74 21.21 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.473 0.546 . . . . 51.31 112.473 -171.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -146.51 160.87 41.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.065 0.765 . . . . 71.42 113.065 -175.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 35' ' ' TYR . 50.6 tp -101.49 116.31 32.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.501 -0.772 . . . . 72.33 111.883 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB2' ' OG1' ' A' ' 36' ' ' THR . 38.0 mt-10 -79.83 129.96 34.92 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.536 -0.302 . . . . 70.2 110.725 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 5' ' ' ILE . 66.5 mt -134.58 121.86 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 122.407 0.283 . . . . 73.04 111.069 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 3' ' ' MET . 42.5 ttm180 -118.66 120.84 38.63 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.073 0.463 . . . . 61.2 111.032 174.559 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' ' 2' ' ' GLU . 49.7 mt -101.49 129.08 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 116.121 -0.49 . . . . 74.51 110.777 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.424 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 57.5 m -120.89 143.39 48.95 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.313 0.245 . . . . 71.41 111.6 -176.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.44 10.91 60.14 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.119 -0.562 . . . . 72.25 114.396 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.465 HG21 ' HE ' ' A' ' 54' ' ' ARG . 19.2 m -89.39 136.4 29.98 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 117.32 0.56 . . . . 74.43 112.077 179.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -73.09 174.32 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.976 2.451 . . . . 71.22 113.316 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 13.7 pt-20 -66.42 -49.38 66.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.624 0.972 . . . . 73.23 113.624 -171.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.21 -41.48 85.7 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.883 -0.51 . . . . 75.21 111.262 -176.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.59 -31.45 48.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.182 0.515 . . . . 70.31 110.992 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.67 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 3.8 tpm_? -52.51 -43.26 64.97 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 72.43 111.321 176.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.85 -52.85 62.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.811 -0.631 . . . . 62.43 111.68 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.74 -43.06 99.58 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.254 -0.43 . . . . 65.35 111.86 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.81 -36.77 84.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.961 0.41 . . . . 73.4 111.491 176.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.26 70.82 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.993 0.425 . . . . 65.35 111.328 176.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -78.3 -34.59 48.7 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 116.284 -0.416 . . . . 61.15 111.452 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.73 -41.49 97.71 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.776 0.287 . . . . 65.25 111.776 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -51.06 -43.59 60.99 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.103 0.478 . . . . 72.41 111.716 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.65 -41.68 95.48 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.117 -0.492 . . . . 73.33 111.416 176.443 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.1 tpt180 -62.71 -52.95 61.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.044 -0.526 . . . . 75.05 110.937 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 18' ' ' ALA . 86.4 mt -50.14 -48.54 53.68 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.89 -0.595 . . . . 71.1 111.998 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.46 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -58.78 -52.65 64.83 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.025 -0.534 . . . . 44.11 111.873 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -62.64 -35.05 78.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.601 0.593 . . . . 73.15 112.601 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.6 mm-40 -55.25 -47.69 75.06 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.251 0.548 . . . . 52.04 111.231 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -93.93 7.6 44.4 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.101 -0.499 . . . . 73.33 111.76 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 60.11 31.39 20.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.424 0.63 . . . . 71.31 111.559 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.5 pt -105.54 171.69 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.046 0.451 . . . . 64.34 111.23 177.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.45 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 47.8 p -97.99 143.04 28.97 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.928 0.394 . . . . 74.5 111.601 -179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 11.1 p -128.62 120.75 53.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.488 0.661 . . . . 62.14 111.986 176.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.5 p -116.09 136.01 53.42 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.761 -0.654 . . . . 75.3 110.178 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -149.39 155.07 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.014 0.746 . . . . 75.1 113.014 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 49.8 m -131.82 132.04 43.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.524 -0.762 . . . . 72.44 110.644 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 HH11 ' A' ' 54' ' ' ARG . 41.8 mm -94.15 122.11 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.575 0.226 . . . . 74.14 111.168 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.585 ' HG3' ' HB2' ' A' ' 2' ' ' GLU . 14.9 ptm180 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.482 0.658 . . . . 73.25 112.259 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 tmm? . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.826 0.346 . . . . 64.31 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -109.66 146.25 35.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.314 -0.403 . . . . 71.32 111.043 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.8 ptm -144.36 119.09 9.83 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.825 0.345 . . . . 75.33 111.928 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.82 130.79 38.31 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.292 -0.413 . . . . 73.13 111.188 177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.2 mt -132.95 112.84 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.376 -0.203 . . . . 71.03 111.38 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -102.73 121.74 43.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.861 0.362 . . . . 65.44 111.765 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -101.39 126.04 48.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.342 -0.39 . . . . 63.42 111.532 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -140.14 132.67 28.67 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.536 -0.302 . . . . 75.21 110.79 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.475 ' HA3' ' HB ' ' A' ' 70' ' ' ILE . . . 168.9 -173.68 43.45 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 119.977 -1.106 . . . . 75.41 114.72 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 2.5 m-20 -87.35 85.75 7.19 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.297 0.48 . . . . 65.14 112.297 -175.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 8.5 t70 178.77 164.92 0.84 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.968 0.507 . . . . 74.21 109.992 174.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.0 tp -113.76 -44.62 3.16 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.949 0.404 . . . . 54.01 111.035 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.55 -25.66 68.34 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.374 -0.376 . . . . 74.24 111.152 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.27 -29.03 30.85 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.81 0.338 . . . . 65.32 111.51 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.402 ' CE1' HD11 ' A' ' 37' ' ' LEU . 73.0 t80 -57.11 -60.15 4.03 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.133 0.492 . . . . 65.41 111.067 174.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 11.7 pt-20 -69.54 -38.56 77.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.319 -0.401 . . . . 72.51 111.567 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.443 ' HG3' ' HZ ' ' A' ' 68' ' ' PHE . 24.1 mmmt -56.75 -54.22 48.79 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 52.2 112.075 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.22 69.36 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.919 0.39 . . . . 72.23 111.846 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.7 -49.48 72.94 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.164 0.431 . . . . 53.4 112.164 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.0 tptp -61.37 -50.63 72.12 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.819 0.342 . . . . 75.54 111.672 -174.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -62.14 -43.82 98.0 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.0 0.37 . . . . 73.11 112.0 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -59.83 -45.38 92.56 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.631 0.253 . . . . 64.35 111.211 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.0 mt -63.26 -42.4 96.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.96 0.41 . . . . 74.01 110.918 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.28 -39.09 74.97 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.08 -0.509 . . . . 71.51 111.156 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -75.77 -50.2 15.94 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.072 0.397 . . . . 72.24 112.072 174.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.63 84.91 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.009 0.744 . . . . 75.13 113.009 -175.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.95 58.97 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.733 0.301 . . . . 64.54 111.701 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -54.86 -33.09 61.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.198 0.523 . . . . 74.51 111.073 175.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -111.91 -168.23 1.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.953 -0.567 . . . . 72.13 111.227 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 16.98 2.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.95 0.405 . . . . 73.52 111.778 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.84 108.19 2.78 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.452 -0.404 . . . . 45.05 113.331 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -82.9 135.49 34.9 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.8 -0.235 . . . . 72.14 110.988 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.6 t -113.28 125.32 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 112.256 0.465 . . . . 71.0 112.256 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 t -122.57 152.5 40.35 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.129 -0.487 . . . . 61.13 110.445 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.51 ' HB2' HD11 ' A' ' 42' ' ' LEU . 38.1 p90 -144.63 141.71 29.58 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.361 0.504 . . . . 71.32 112.361 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.0 p -133.91 135.8 43.85 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.287 -0.415 . . . . 65.21 111.152 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.402 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.58 127.56 35.26 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.596 0.236 . . . . 61.43 111.53 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -123.16 94.15 4.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.132 0.492 . . . . 74.31 111.645 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.78 -75.54 0.72 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.303 -0.475 . . . . 73.43 113.718 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -139.75 11.38 2.47 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.523 0.564 . . . . 73.13 112.523 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -137.47 159.97 40.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.392 0.615 . . . . 75.22 112.446 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 35' ' ' TYR . 58.0 tp -105.7 119.21 38.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.667 -0.697 . . . . 64.34 111.823 -179.263 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.506 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 29.7 mt-10 -91.18 104.14 16.74 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.459 -0.337 . . . . 64.03 111.233 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.49 109.61 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 120.691 0.281 . . . . 74.1 111.578 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 45' ' ' ARG . 31.1 ttp180 -110.93 125.99 54.25 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.076 0.465 . . . . 72.03 111.666 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.0 mt -108.12 139.53 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 116.415 -0.357 . . . . 62.14 110.808 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.8 m -120.42 130.61 54.42 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.386 0.513 . . . . 72.05 112.386 -175.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.75 40.53 45.15 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.907 0.723 . . . . 64.43 114.907 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.8 m -95.23 152.85 39.69 Favored Pre-proline 0 N--CA 1.469 0.516 0 O-C-N 122.302 -0.529 . . . . 74.53 111.592 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.465 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 11.3 Cg_endo -55.11 117.16 3.72 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.779 2.319 . . . . 74.43 112.724 176.222 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.39 -29.97 11.29 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.955 0.724 . . . . 72.21 112.955 -178.001 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.457 ' O ' ' HE3' ' A' ' 55' ' ' LYS . 29.8 pt20 -76.11 -46.59 28.08 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.142 0.423 . . . . 73.41 112.142 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.465 ' HB ' ' HG2' ' A' ' 50' ' ' PRO . 58.8 t -67.61 -19.94 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-O 121.31 0.576 . . . . 51.3 110.844 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 7.0 ttp180 -46.17 -33.58 3.69 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.688 -0.687 . . . . 73.42 112.374 175.044 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 52' ' ' GLN . 17.1 ptpt -60.29 -45.11 94.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.715 0.293 . . . . 72.51 111.455 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -74.84 -34.15 62.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.744 0.307 . . . . 73.54 111.18 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.36 -48.38 78.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.906 0.384 . . . . 62.34 111.248 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.04 -38.97 83.14 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.082 0.468 . . . . 60.42 110.982 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -58.77 -43.46 90.4 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.805 -0.634 . . . . 73.43 111.136 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -60.26 -42.35 95.17 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.124 -0.489 . . . . 73.5 110.996 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.462 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -53.84 -49.03 69.33 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.967 0.413 . . . . 72.51 111.618 177.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.34 -36.37 83.49 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.072 0.463 . . . . 52.23 111.259 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -69.08 -37.01 78.23 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.358 -0.383 . . . . 64.15 111.333 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 61' ' ' ALA . 79.7 mt -59.57 -44.01 93.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.277 0.56 . . . . 54.15 110.223 174.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.88 -48.55 81.29 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.78 -0.646 . . . . 40.33 111.038 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -60.58 -33.79 73.24 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.306 0.484 . . . . 72.23 112.306 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -57.56 -36.86 72.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.12 0.486 . . . . 75.1 111.049 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.443 ' HZ ' ' HG3' ' A' ' 17' ' ' LYS . 85.4 m-85 -111.05 7.06 21.34 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.204 -0.453 . . . . 74.05 111.25 177.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 55.58 28.51 11.99 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.06 0.544 . . . . 74.32 112.151 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.475 ' HB ' ' HA3' ' A' ' 9' ' ' GLY . 32.2 pt -95.18 -178.25 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 112.675 0.62 . . . . 74.31 112.675 -176.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.1 m -91.79 141.37 28.74 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.97 -0.559 . . . . 61.31 111.694 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.41 118.71 23.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.041 0.448 . . . . 63.51 111.237 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -115.22 120.84 41.05 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.266 -0.271 . . . . 64.34 110.469 177.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -127.92 137.3 52.24 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.301 0.572 . . . . 62.42 112.308 -175.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.0 m -113.74 111.67 22.18 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.001 -0.545 . . . . 52.13 110.822 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -123.03 116.01 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.725 0.297 . . . . 65.24 111.312 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 . . . . . 0 N--CA 1.47 0.537 0 C-N-CA 122.522 0.329 . . . . 70.01 110.757 179.656 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.835 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.9 mtp . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.01 0.433 . . . . 62.2 111.382 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' A' ' 77' ' ' ARG . 0.6 OUTLIER -122.51 119.11 29.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.791 -0.818 . . . . 74.32 108.791 178.098 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.583 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.0 ttt -124.38 122.21 37.06 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.017 1.117 . . . . 75.51 114.017 -165.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' A' ' 75' ' ' THR . 1.0 OUTLIER -89.61 123.94 34.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.314 -0.857 . . . . 72.3 110.272 171.415 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 41.0 mt -130.4 108.73 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.958 0.409 . . . . 74.5 111.257 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -109.49 108.04 18.38 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.428 0.529 . . . . 53.5 112.428 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -89.84 156.04 18.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.836 -0.62 . . . . 74.14 110.708 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.537 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 42.1 ttp180 -142.42 120.4 12.06 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.171 0.51 . . . . 73.32 111.387 171.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.94 131.53 2.38 Favored Glycine 0 CA--C 1.522 0.507 0 CA-C-N 115.826 -0.625 . . . . 40.24 112.493 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.68 -5.44 55.15 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 122.427 -0.455 . . . . 64.43 111.654 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 14' ' ' ALA . 9.6 m-20 -73.02 101.22 3.18 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 73.01 110.709 174.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 30.4 tp -61.97 -26.98 68.53 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.046 0.387 . . . . 74.23 112.046 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -73.44 -36.35 65.89 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.024 -0.423 . . . . 73.4 110.527 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 11' ' ' ASP . . . -66.74 -31.75 72.6 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.893 0.378 . . . . 73.1 110.819 175.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.451 ' HE1' HD13 ' A' ' 42' ' ' LEU . 60.6 t80 -55.26 -48.17 74.38 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.114 0.483 . . . . 75.21 110.331 171.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 9.0 tm-20 -60.45 -50.42 73.66 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.824 -0.626 . . . . 74.11 110.86 176.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -56.63 -54.35 47.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.403 0.52 . . . . 74.32 112.403 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -56.17 -53.36 58.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.891 0.33 . . . . 70.2 111.891 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.48 -36.74 83.45 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.061 0.458 . . . . 73.52 110.786 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.9 tptm -59.03 -51.05 71.72 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.041 -0.527 . . . . 72.34 111.73 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.577 ' HG3' HD21 ' A' ' 64' ' ' LEU . 7.8 mm-40 -61.65 -47.52 85.0 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.913 -0.585 . . . . 72.53 111.82 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.521 ' HB3' HD11 ' A' ' 46' ' ' ILE . 51.3 mmm -61.88 -40.38 95.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.781 0.324 . . . . 74.31 111.301 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.0 mt -67.79 -37.58 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 120.787 0.327 . . . . 72.21 110.867 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 21' ' ' GLU . 60.2 ttp85 -54.91 -42.5 72.25 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.884 0.373 . . . . 74.31 111.094 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -74.19 -48.04 31.73 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.951 0.405 . . . . 72.43 111.509 175.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.77 -46.66 71.04 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.752 0.649 . . . . 71.45 112.752 -175.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -56.4 -34.3 66.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 75.53 111.603 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -72.84 -32.63 65.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.072 0.463 . . . . 63.34 111.372 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.43 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 24.9 m-85 -96.35 -6.28 38.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.321 -0.399 . . . . 74.35 111.854 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 62.12 27.21 16.4 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.126 0.489 . . . . 64.1 111.516 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.94 156.87 36.75 Favored Glycine 0 CA--C 1.527 0.802 0 CA-C-N 116.126 -0.488 . . . . 74.12 113.262 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 78.0 m -88.32 128.66 35.49 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.731 -0.276 . . . . 74.22 110.949 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.509 HG22 HG12 ' A' ' 46' ' ' ILE . 61.1 t -123.78 114.47 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 121.047 0.451 . . . . 75.13 112.054 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.8 t -106.53 154.4 20.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.274 -0.421 . . . . 70.43 110.464 173.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.593 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 41.1 p90 -145.67 138.08 25.66 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.094 0.473 . . . . 74.23 112.144 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.8 p -132.9 134.43 44.56 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.119 -0.491 . . . . 74.52 111.049 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.57 100.91 12.32 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.777 0.322 . . . . 52.55 111.133 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -97.61 97.58 9.17 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.828 0.346 . . . . 73.04 110.864 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 -78.04 0.13 Allowed Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.357 -0.449 . . . . 62.24 113.055 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -143.31 15.81 1.86 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.541 -0.388 . . . . 74.12 111.342 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' ' HD3' ' A' ' 8' ' ' ARG . 3.9 m-20 -107.17 128.67 54.61 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.217 -0.447 . . . . 74.45 111.211 177.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.451 HD13 ' HE1' ' A' ' 15' ' ' PHE . 46.8 tp -95.5 101.72 13.46 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.278 0.561 . . . . 54.23 111.358 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.593 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.7 tt0 -89.53 107.18 18.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.108 -0.497 . . . . 74.53 111.642 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.8 mt -113.07 117.62 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 122.624 0.369 . . . . 71.35 110.88 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 4' ' ' ASP . 74.0 mtt180 -116.86 122.92 45.75 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.823 -0.548 . . . . 71.02 111.865 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 22' ' ' MET . 51.2 mt -110.0 115.06 48.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.995 -0.548 . . . . 71.12 111.593 -176.162 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 2' ' ' GLU . 60.4 m -100.48 127.01 46.94 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.116 -0.493 . . . . 74.23 111.548 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.43 57.29 1.13 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 121.152 -0.547 . . . . 62.44 113.627 175.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.515 HG23 ' HB2' ' A' ' 1' ' ' MET . 18.5 m -118.11 138.73 25.81 Favored Pre-proline 0 CA--C 1.541 0.63 0 CA-C-O 120.748 0.309 . . . . 52.31 111.445 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 16.8 Cg_exo -68.14 140.46 49.49 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.008 2.472 . . . . 75.43 113.389 -177.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.835 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 11.6 pt-20 -54.64 -41.08 69.63 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.73 0.641 . . . . 44.43 112.73 -178.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -66.14 -24.09 66.6 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.271 0.471 . . . . 73.55 112.271 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.528 HG12 ' HG ' ' A' ' 57' ' ' LEU . 40.1 t -84.53 -10.19 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-O 120.912 0.387 . . . . 75.04 111.684 -177.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' HD12 ' A' ' 76' ' ' ILE . 4.1 tpt180 -43.73 -45.17 6.99 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.641 0.377 . . . . 72.44 111.989 175.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.96 -31.44 72.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.157 -0.474 . . . . 73.23 111.836 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -77.07 -53.85 7.27 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.873 0.368 . . . . 70.51 111.694 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.528 ' HG ' HG12 ' A' ' 53' ' ' VAL . 82.5 mt -56.0 -53.52 55.9 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.582 0.586 . . . . 75.31 112.582 -174.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.18 -40.6 94.5 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.966 0.413 . . . . 51.42 111.51 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -62.66 -40.94 98.62 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.319 -0.4 . . . . 71.03 111.539 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -74.2 -34.8 63.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.826 0.346 . . . . 75.31 111.262 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.71 -47.49 85.43 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.911 0.386 . . . . 55.11 110.879 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.48 -31.47 71.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.43 -0.35 . . . . 73.12 111.34 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -55.59 -53.37 57.35 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.981 -0.377 . . . . 74.42 109.981 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.577 HD21 ' HG3' ' A' ' 21' ' ' GLU . 54.4 mt -49.87 -43.08 49.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.925 -0.579 . . . . 64.24 112.047 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -57.39 12.88 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.001 0.429 . . . . 44.41 111.577 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -69.6 -28.21 65.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 120.999 0.428 . . . . 44.21 111.828 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.73 -36.99 59.78 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.07 0.548 . . . . 70.1 111.805 -176.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -111.56 7.49 20.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 120.896 0.379 . . . . 64.01 111.883 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 66.24 13.38 9.14 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.36 0.664 . . . . 75.32 112.088 176.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.7 pt -88.64 178.26 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 116.55 -0.295 . . . . 63.12 111.186 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.537 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 57.0 p -107.1 156.06 19.19 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.063 0.459 . . . . 72.13 112.144 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.78 131.8 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 121.35 0.595 . . . . 71.15 111.686 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.8 p -132.05 121.76 24.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.154 -0.475 . . . . 72.11 110.072 174.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -129.49 130.06 45.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.903 0.705 . . . . 73.4 112.903 -176.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.496 ' O ' ' HB3' ' A' ' 4' ' ' ASP . 68.3 m -113.84 121.91 45.45 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.683 -0.689 . . . . 54.02 110.783 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.583 HG12 ' HG3' ' A' ' 3' ' ' MET . 25.1 mt -101.08 126.83 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.128 0.49 . . . . 72.32 112.306 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 26.0 mmm180 . . . . . 0 CA--C 1.539 0.549 0 CA-C-N 116.129 -0.487 . . . . 71.22 110.917 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.578 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 69.3 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.836 0.351 . . . . 70.3 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.74 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 40.2 mt-10 -95.2 132.92 39.63 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 109.711 -0.477 . . . . 72.34 109.711 170.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.504 ' O ' ' HA ' ' A' ' 45' ' ' ARG . 23.8 ttt -114.49 106.54 14.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.988 0.423 . . . . 70.43 110.23 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 12.5 t70 -99.67 108.44 20.8 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.197 -0.456 . . . . 35.34 111.241 -172.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 58.6 mt -127.83 111.81 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 116.426 -0.352 . . . . 73.35 110.654 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -118.32 119.79 35.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.343 0.592 . . . . 75.51 112.265 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -94.17 155.53 17.01 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.802 -0.635 . . . . 73.21 111.237 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -124.13 120.02 31.13 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.888 0.375 . . . . 75.05 110.192 168.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.9 135.36 10.71 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.945 -0.645 . . . . 74.21 113.306 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.41 -43.68 59.97 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.849 0.357 . . . . 72.14 111.667 177.634 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -88.58 -171.48 3.35 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.067 0.46 . . . . 74.23 112.124 -178.574 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 54.1 tp -95.93 -52.55 4.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.545 0.572 . . . . 74.34 112.545 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -61.58 -26.75 68.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.932 0.716 . . . . 64.44 112.932 -172.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.5 -30.98 44.01 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.978 0.418 . . . . 43.12 111.026 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -59.77 -57.8 11.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.845 -0.616 . . . . 71.04 111.365 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.59 -51.16 59.48 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.131 0.419 . . . . 64.33 112.131 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 35.8 mmtp -55.27 -54.31 45.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.435 -0.348 . . . . 75.13 111.721 -176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.72 -51.99 59.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.972 0.36 . . . . 63.25 111.972 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.488 ' HB2' HD21 ' A' ' 42' ' ' LEU . 67.2 tp -55.88 -48.53 75.41 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.369 -0.378 . . . . 72.12 111.822 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -62.35 -40.84 97.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.248 0.462 . . . . 62.14 112.248 -176.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 18.6 mm-40 -60.05 -51.56 69.1 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.624 0.25 . . . . 71.51 111.174 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.4 mtp -59.38 -44.57 92.75 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.019 0.438 . . . . 72.31 111.268 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 54.0 mt -60.37 -37.15 73.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.407 -0.36 . . . . 62.4 111.219 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -57.73 -53.38 58.89 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.836 0.35 . . . . 75.24 111.397 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -68.55 -41.61 79.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.852 0.316 . . . . 63.14 111.852 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.5 96.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.736 0.643 . . . . 74.24 112.736 -176.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 27' ' ' ARG . 28.5 mtp85 -60.04 -27.53 67.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.626 0.602 . . . . 72.24 112.626 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -58.16 -23.95 57.14 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.399 0.618 . . . . 70.43 110.965 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -114.21 -164.6 0.94 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.949 -0.569 . . . . 72.22 110.706 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.11 9.83 11.65 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.88 0.371 . . . . 53.22 111.599 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.25 86.95 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 CA-C-N 116.198 -0.456 . . . . 71.44 113.589 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 m -71.55 117.03 12.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.806 0.336 . . . . 71.53 110.963 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 56.6 t -99.19 125.23 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.38 0.511 . . . . 64.45 112.38 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.1 t -121.14 138.53 54.16 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.302 -0.408 . . . . 74.22 110.799 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.558 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.2 p90 -134.19 137.15 44.22 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.366 0.506 . . . . 75.05 112.366 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 p -124.35 138.96 54.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.198 -0.455 . . . . 72.13 111.187 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -108.08 131.6 54.43 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.045 0.45 . . . . 51.5 111.918 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -145.01 119.96 9.99 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.294 -0.412 . . . . 53.13 110.588 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 -86.72 0.07 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.105 -0.569 . . . . 73.51 112.99 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -144.92 10.77 1.36 Allowed 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.042 0.449 . . . . 71.32 111.45 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -95.32 122.78 38.38 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.165 -0.47 . . . . 74.33 111.514 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 19' ' ' LEU . 33.6 tp -96.45 103.92 15.86 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.138 -0.483 . . . . 65.4 110.578 173.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.2 mt-10 -90.08 104.46 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.353 -0.385 . . . . 75.52 111.464 -177.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -105.24 109.46 27.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.73 0.3 . . . . 74.3 111.451 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 3' ' ' MET . 37.9 ttm180 -111.82 115.27 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.86 -0.525 . . . . 75.42 111.364 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 44.7 mt -92.99 137.03 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.206 -0.452 . . . . 72.22 110.508 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.9 m -125.51 125.2 42.88 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 111.862 0.319 . . . . 62.44 111.862 -175.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.16 58.93 1.91 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.362 -0.447 . . . . 72.5 114.143 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 18.5 m -117.16 144.63 34.1 Favored Pre-proline 0 N--CA 1.474 0.735 0 O-C-N 122.248 -0.56 . . . . 74.01 111.912 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.66 130.73 32.57 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.412 2.075 . . . . 71.12 111.626 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.18 -28.58 62.94 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.533 0.938 . . . . 72.35 113.533 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -68.1 -38.01 81.81 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 122.062 -0.399 . . . . 73.45 111.287 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -77.69 -27.23 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 121.129 0.49 . . . . 64.3 110.89 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.578 ' NH1' ' SD ' ' A' ' 1' ' ' MET . 50.3 ttp180 -49.0 -38.7 24.09 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.74 -0.664 . . . . 71.33 111.517 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -60.18 -49.09 79.01 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.166 -0.47 . . . . 74.4 111.751 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -66.98 -41.51 86.68 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.08 -0.509 . . . . 64.3 112.285 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.33 -42.96 99.54 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.864 0.364 . . . . 63.1 111.312 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.36 94.95 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.224 0.535 . . . . 72.44 111.138 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -67.93 -31.14 70.69 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.836 -0.62 . . . . 64.33 111.541 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.77 -33.32 70.65 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.977 0.418 . . . . 63.42 110.39 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.4 91.87 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.121 0.486 . . . . 52.02 110.925 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.95 -41.74 92.5 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.353 0.596 . . . . 71.13 110.534 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -57.16 -48.99 77.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.76 -0.654 . . . . 75.45 111.087 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.57 -40.23 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.174 -0.466 . . . . 74.22 111.392 177.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.45 -49.01 78.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.192 -0.458 . . . . 64.22 111.279 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.14 -33.82 76.92 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.938 0.399 . . . . 72.14 111.271 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.39 -55.24 29.78 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.186 -0.461 . . . . 75.11 111.489 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -93.24 2.52 56.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.272 0.471 . . . . 73.54 112.272 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m120 58.63 31.87 21.56 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.068 0.461 . . . . 74.52 111.297 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 29.2 pt -103.88 171.55 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-O 121.148 0.499 . . . . 62.24 112.004 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 97.7 m -98.49 141.37 31.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.106 -0.497 . . . . 53.03 111.301 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -147.54 142.99 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.41 -0.359 . . . . 72.45 111.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.1 p -118.71 147.88 43.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.751 0.31 . . . . 43.43 110.78 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.4 p90 -143.82 123.9 13.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.122 0.487 . . . . 72.25 111.969 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.9 m -131.81 143.61 50.32 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 116.381 -0.372 . . . . 65.22 111.4 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.31 105.66 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-O 121.197 0.522 . . . . 65.11 111.545 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.74 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 19.6 mtp180 . . . . . 0 CA--C 1.54 0.592 0 CA-C-O 121.328 0.585 . . . . 63.54 111.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tmm? . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 110.298 -0.26 . . . . 51.44 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.549 ' HG2' HG23 ' A' ' 47' ' ' THR . 36.3 mt-10 -135.88 140.99 44.53 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.864 0.466 . . . . 70.51 110.714 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 14.8 ptm -144.23 120.06 10.57 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.202 0.445 . . . . 74.5 112.202 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.626 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 29.4 m-20 -90.67 104.63 17.19 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.548 -0.296 . . . . 64.03 110.919 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.3 mt -103.8 109.2 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.726 0.298 . . . . 62.01 110.936 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 4.8 ptp180 -108.47 125.61 51.97 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.256 0.55 . . . . 74.12 112.26 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -102.85 132.06 49.31 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.475 -0.784 . . . . 52.13 111.371 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -142.94 119.9 11.32 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.578 0.228 . . . . 71.21 110.665 174.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.86 160.28 30.22 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 120.826 -0.702 . . . . 74.45 113.312 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -86.3 89.05 7.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.968 0.414 . . . . 75.44 112.006 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -165.33 165.64 19.27 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.067 -0.515 . . . . 74.22 109.996 173.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -106.85 -52.16 2.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.673 0.273 . . . . 65.12 111.6 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.58 -25.6 62.26 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.313 0.486 . . . . 54.13 112.313 -178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.53 -30.17 40.37 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.078 0.399 . . . . 72.11 112.078 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CE1' HD21 ' A' ' 37' ' ' LEU . 59.7 t80 -58.96 -60.22 4.21 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.821 0.343 . . . . 71.42 111.178 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.74 -44.4 86.02 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.225 -0.443 . . . . 64.44 111.285 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.11 -56.13 26.03 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.081 -0.509 . . . . 62.1 112.084 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -44.33 96.13 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.119 0.485 . . . . 52.45 111.624 -177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 23' ' ' ILE . 45.0 tp -62.09 -56.16 21.69 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.93 -0.577 . . . . 63.41 111.779 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -63.09 -41.21 99.34 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.127 0.417 . . . . 52.2 112.127 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -54.97 -47.72 74.2 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.609 0.242 . . . . 71.33 111.515 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 45.0 mtp -72.77 -36.39 67.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.667 0.27 . . . . 74.4 111.552 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 19' ' ' LEU . 63.7 mt -57.29 -34.53 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.739 0.304 . . . . 75.5 111.274 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 24' ' ' ARG . 37.1 ttp180 -48.92 -46.72 43.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.304 -0.407 . . . . 71.21 111.577 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -74.46 -43.54 55.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.633 0.254 . . . . 73.02 111.297 174.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.08 -34.57 63.74 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.639 0.607 . . . . 71.51 112.639 -177.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 6.5 mmp_? -60.53 -28.98 68.83 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.759 0.314 . . . . 72.3 111.65 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.408 ' HE3' ' N ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.61 -13.22 60.62 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.412 0.285 . . . . 62.0 111.746 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.73 151.54 28.81 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.211 0.529 . . . . 73.03 112.043 -177.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.21 57.05 1.05 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.015 0.436 . . . . 63.02 111.233 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.52 -168.26 12.98 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.344 -0.455 . . . . 52.51 113.491 -177.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 95.8 m -103.83 127.83 51.3 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.619 -0.342 . . . . 73.44 111.751 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.7 t -131.84 110.84 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.756 0.312 . . . . 74.41 110.705 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.3 t -121.76 162.5 20.73 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.922 0.391 . . . . 61.12 111.767 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.595 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 30.3 p90 -156.41 139.44 15.42 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.083 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 t -137.09 133.75 35.71 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.573 0.582 . . . . 73.14 112.573 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.403 HD21 ' CE1' ' A' ' 15' ' ' PHE . 3.6 mm? -94.19 102.21 14.23 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.072 -0.513 . . . . 70.24 110.99 176.31 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -118.27 106.0 12.33 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.065 0.459 . . . . 73.33 111.013 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.54 -85.22 0.44 Allowed Glycine 0 CA--C 1.525 0.695 0 C-N-CA 121.208 -0.52 . . . . 55.0 112.808 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -146.14 15.39 1.33 Allowed 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.763 0.316 . . . . 74.4 111.545 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -117.66 130.28 56.26 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.47 -0.332 . . . . 71.2 110.856 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 48.8 tp -102.94 102.6 12.68 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.437 -0.347 . . . . 73.03 111.271 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 27.3 mm-40 -87.97 106.57 18.21 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.515 -0.311 . . . . 50.03 111.177 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.41 HD11 HD21 ' A' ' 42' ' ' LEU . 54.1 mt -111.69 110.23 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 120.557 0.218 . . . . 73.12 111.001 177.114 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.3 ttt85 -107.1 122.6 46.8 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.945 -0.472 . . . . 73.42 111.721 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.5 mt -106.89 127.84 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 116.094 -0.503 . . . . 73.14 110.407 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -130.14 128.41 41.73 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.284 0.476 . . . . 71.23 112.284 -174.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.82 32.55 7.93 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 114.613 0.605 . . . . 45.0 114.613 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.67 141.44 24.65 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 117.506 0.653 . . . . 64.44 111.326 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.491 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 21.2 Cg_endo -59.14 133.62 54.21 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.797 2.331 . . . . 73.15 112.974 -178.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -59.58 -25.35 64.52 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.354 0.501 . . . . 71.42 112.354 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 50' ' ' PRO . 29.0 pt20 -60.34 -34.09 73.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.76 0.314 . . . . 75.13 111.743 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.456 HG23 ' HG3' ' A' ' 52' ' ' GLN . 42.9 t -91.49 -24.42 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.001 0.429 . . . . 75.21 110.827 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.624 ' HD3' HD13 ' A' ' 76' ' ' ILE . 5.9 tmm_? -47.88 -41.82 25.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.016 0.527 . . . . 64.42 111.49 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -61.2 -42.51 98.72 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.872 0.368 . . . . 74.44 111.81 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -66.0 -45.39 81.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.883 0.373 . . . . 72.53 110.684 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.34 -43.68 83.61 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.143 0.497 . . . . 72.42 111.247 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -64.07 -46.21 85.32 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.072 -0.513 . . . . 72.24 111.719 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -71.64 -34.19 69.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.19 0.441 . . . . 73.02 112.19 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.95 -37.16 86.39 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.169 0.509 . . . . 70.03 109.988 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -63.51 -38.79 92.48 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.889 -0.596 . . . . 64.1 111.163 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 45.5 mt-10 -58.07 -40.89 82.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.858 0.361 . . . . 75.55 110.968 175.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -61.24 -44.43 97.26 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.653 -0.249 . . . . 74.45 111.032 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.535 HD12 ' HA ' ' A' ' 61' ' ' ALA . 81.4 mt -50.46 -40.85 51.95 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.076 0.465 . . . . 75.44 111.127 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.613 ' HB2' HG12 ' A' ' 72' ' ' VAL . . . -65.8 -56.85 9.78 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.198 -0.455 . . . . 53.23 111.73 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.35 -23.92 67.11 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.19 -0.459 . . . . 72.02 112.087 -177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -82.44 -56.23 4.01 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.1 0.476 . . . . 74.41 111.431 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -94.05 4.61 53.66 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.153 0.427 . . . . 73.51 112.153 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 61.81 20.26 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.439 0.533 . . . . 61.22 112.439 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 23.8 pt -90.17 153.13 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 116.282 -0.417 . . . . 63.04 111.366 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.5 m -87.98 122.22 31.32 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.257 -0.277 . . . . 74.23 111.252 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.613 HG12 ' HB2' ' A' ' 65' ' ' ALA . 12.5 p -123.88 133.62 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.26 0.552 . . . . 71.22 111.591 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 p -142.62 142.02 32.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.219 -0.446 . . . . 72.11 110.713 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.626 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 13.6 p90 -137.24 128.59 28.14 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.822 0.675 . . . . 73.05 112.822 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.4 m -102.78 123.86 47.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.89 -0.596 . . . . 72.23 110.197 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.624 HD13 ' HD3' ' A' ' 54' ' ' ARG . 34.3 mt -122.99 139.46 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.78 0.659 . . . . 51.22 112.78 -169.525 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' A' ' 77' ' ' ARG . 14.0 ptm180 . . . . . 0 N--CA 1.468 0.438 0 CA-C-N 115.982 -0.554 . . . . 75.35 110.781 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 47.8 ttp . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.562 0.22 . . . . 72.3 110.826 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -125.8 153.51 43.95 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.245 0.461 . . . . 73.32 112.245 -175.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -148.29 112.14 5.11 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.951 -0.568 . . . . 73.12 110.979 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.581 ' HB3' ' HG2' ' A' ' 45' ' ' ARG . 2.3 p-10 -99.11 119.8 38.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.525 0.678 . . . . 74.51 111.866 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.515 HD13 ' HB2' ' A' ' 61' ' ' ALA . 56.4 mt -111.61 114.83 48.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 115.98 -0.555 . . . . 73.03 111.576 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.411 ' HD3' ' OD2' ' A' ' 41' ' ' ASP . 1.3 tmm_? -101.13 112.52 25.01 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.987 0.423 . . . . 73.04 111.549 -177.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 97.8 m-85 -91.19 156.04 18.14 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.75 0.309 . . . . 62.4 111.555 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 65.1 ttt180 -139.91 121.52 15.25 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.586 -0.279 . . . . 73.25 111.206 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.25 163.82 36.73 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.164 -0.541 . . . . 53.33 113.262 178.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -87.31 -35.74 18.25 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.946 0.403 . . . . 73.34 111.525 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.7 119.68 9.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.047 -0.524 . . . . 73.44 112.036 -177.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.95 -39.86 93.57 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.076 0.465 . . . . 71.22 110.87 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 1.8 mp0 -61.9 -27.88 69.13 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.091 -0.504 . . . . 74.33 111.744 177.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' A' ' 70' ' ' ILE . . . -58.97 -39.65 82.38 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.828 0.347 . . . . 75.54 111.13 177.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -67.89 -53.92 22.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.33 -0.396 . . . . 75.52 111.642 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.0 pt-20 -62.38 -42.56 99.51 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.1 0.407 . . . . 51.13 112.1 -177.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.499 ' NZ ' ' HB3' ' A' ' 17' ' ' LYS . 4.2 mmmp? -65.29 -42.62 92.93 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 122.296 -0.252 . . . . 74.25 111.437 178.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.525 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -62.24 -47.54 83.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.209 0.528 . . . . 72.02 111.432 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.14 -43.99 97.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.975 -0.557 . . . . 63.45 111.146 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -60.95 -48.31 82.4 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.246 -0.434 . . . . 74.34 111.593 -178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -57.95 -53.21 60.75 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.915 0.339 . . . . 73.14 111.915 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.418 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.3 mmm -59.55 -48.6 81.03 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.774 0.321 . . . . 72.52 111.704 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.608 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.8 mt -64.64 -42.77 96.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.764 0.283 . . . . 64.13 111.764 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -51.66 -47.44 63.79 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.727 0.299 . . . . 74.14 111.666 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -72.14 -44.23 63.45 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.83 0.348 . . . . 71.41 111.315 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.57 -31.46 69.47 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.003 0.742 . . . . 74.51 113.003 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 79.5 mtp180 -58.88 -28.47 66.17 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.023 0.379 . . . . 74.15 112.023 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -70.41 -13.56 62.19 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.962 0.41 . . . . 73.11 111.391 178.366 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.13 117.72 32.01 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.454 -0.339 . . . . 74.5 110.663 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.49 87.85 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.782 0.66 . . . . 74.55 112.782 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.31 -153.8 6.23 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 115.939 -0.573 . . . . 74.44 112.461 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.3 m -148.09 136.0 21.02 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.758 0.313 . . . . 63.33 111.188 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.1 t -117.42 124.76 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 120.994 0.426 . . . . 75.32 111.545 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.1 t -117.79 153.54 33.27 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.389 -0.369 . . . . 53.53 110.281 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 37.6 p90 -141.8 141.93 33.18 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.61 0.596 . . . . 71.11 112.61 -173.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 17.2 m -119.18 123.36 44.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.091 -0.504 . . . . 72.25 111.14 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.46 121.54 41.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.575 0.226 . . . . 73.23 111.203 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.73 84.53 2.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.093 0.473 . . . . 71.01 111.247 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.53 -91.84 0.04 OUTLIER Glycine 0 CA--C 1.532 1.11 0 CA-C-N 116.226 -0.443 . . . . 45.15 113.56 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 17.7 m-80 -95.91 -15.04 22.66 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 122.548 -0.383 . . . . 74.33 111.609 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.411 ' OD2' ' HD3' ' A' ' 6' ' ' ARG . 4.6 m-20 -97.83 149.41 22.39 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.766 0.654 . . . . 74.5 112.766 -173.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 38.0 tp -138.82 100.7 4.12 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.451 -0.795 . . . . 45.2 110.671 175.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.509 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 38.2 tt0 -89.78 104.37 16.94 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.56 -0.291 . . . . 75.23 111.387 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.75 108.72 24.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.964 0.412 . . . . 60.42 111.08 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 4' ' ' ASP . 94.1 mtt180 -97.82 108.91 21.72 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.743 0.306 . . . . 71.43 111.384 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.6 mt -94.48 121.94 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.76 0.314 . . . . 60.33 110.803 177.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.3 m -119.06 127.97 53.91 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.859 0.318 . . . . 60.2 111.859 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.91 61.79 1.26 Allowed Glycine 0 CA--C 1.527 0.837 0 C-N-CA 121.141 -0.552 . . . . 60.01 113.929 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.81 146.52 61.69 Favored Pre-proline 0 CA--C 1.542 0.669 0 O-C-N 122.504 -0.409 . . . . 60.15 111.554 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.73 137.59 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.514 2.143 . . . . 71.34 112.446 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG3' ' CZ ' ' A' ' 54' ' ' ARG . 36.4 tt0 -55.69 -36.73 67.47 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.879 0.696 . . . . 65.21 112.879 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.06 -30.58 68.17 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.041 0.448 . . . . 75.55 111.529 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.458 HG12 ' HG ' ' A' ' 57' ' ' LEU . 59.7 t -92.66 -32.33 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.515 -0.312 . . . . 73.55 111.281 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.554 ' HD2' HG21 ' A' ' 76' ' ' ILE . 46.4 ttp180 -47.22 -39.5 14.26 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.257 0.551 . . . . 72.42 111.338 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -52.9 -49.06 66.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.55 -0.75 . . . . 62.15 111.432 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.11 -34.87 59.48 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.114 -0.494 . . . . 72.34 111.556 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.458 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.9 mt -61.23 -33.33 73.32 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.027 0.441 . . . . 72.54 111.198 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.54 -39.08 88.4 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.017 0.437 . . . . 63.24 110.845 174.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -70.95 -29.55 65.59 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.35 -0.386 . . . . 72.53 111.638 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 7.1 mm-40 -54.77 -38.21 66.95 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.911 0.386 . . . . 71.21 110.523 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.546 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -58.22 -44.04 87.98 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.129 -0.487 . . . . 75.35 111.053 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.05 -41.46 97.38 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.244 -0.435 . . . . 75.53 111.146 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -63.21 -44.29 95.73 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.867 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 18' ' ' ALA . 96.2 mt -63.05 -37.18 86.18 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.084 -0.507 . . . . 62.54 111.606 178.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.19 77.89 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.197 0.522 . . . . 70.3 110.703 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.84 -25.93 63.97 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.039 -0.528 . . . . 63.31 111.687 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.12 -53.1 62.08 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.125 0.488 . . . . 61.44 111.367 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -110.52 16.64 21.41 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.05 0.389 . . . . 73.24 112.05 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 60.6 23.8 13.55 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.896 0.379 . . . . 74.04 111.917 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.549 HD13 ' HB1' ' A' ' 14' ' ' ALA . 31.2 pt -91.13 179.22 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.219 0.533 . . . . 61.4 111.933 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.5 m -101.33 149.86 23.6 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.208 -0.451 . . . . 71.31 111.223 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.546 HG21 ' HB1' ' A' ' 61' ' ' ALA . 11.2 p -144.92 133.85 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.423 0.63 . . . . 65.33 112.615 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -133.07 128.56 36.48 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.766 -0.652 . . . . 65.05 110.137 173.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -128.22 153.17 47.22 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.645 0.609 . . . . 72.33 112.645 -175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.3 m -127.49 132.69 49.94 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.846 -0.616 . . . . 44.43 110.737 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.554 HG21 ' HD2' ' A' ' 54' ' ' ARG . 39.5 mt -121.48 110.12 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.167 0.508 . . . . 72.15 111.564 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.3 ptm85 . . . . . 0 CA--C 1.537 0.458 0 CA-C-N 115.921 -0.581 . . . . 74.32 111.35 -178.866 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE1' ' HD3' ' A' ' 54' ' ' ARG . 41.0 ttp . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.944 0.402 . . . . 44.22 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.416 ' N ' ' HG2' ' A' ' 1' ' ' MET . 29.9 mt-10 -100.04 147.0 26.09 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.196 -0.456 . . . . 54.44 110.293 173.12 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.469 ' HA ' HG12 ' A' ' 76' ' ' ILE . 21.7 ttt -148.36 108.25 4.03 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.11 0.481 . . . . 62.31 112.076 177.025 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.502 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 8.3 m-20 -92.97 110.15 21.61 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.627 174.034 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -115.6 116.88 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.739 -0.209 . . . . 72.52 110.78 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' ' HA ' ' A' ' 72' ' ' VAL . 1.8 ptp85 -105.76 128.51 53.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.338 0.496 . . . . 60.12 112.338 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -105.06 126.04 51.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.756 -0.656 . . . . 74.34 109.665 172.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -117.03 121.95 42.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.755 0.312 . . . . 73.24 111.238 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.52 157.97 19.58 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 116.043 -0.526 . . . . 65.33 112.346 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -93.46 -10.45 34.98 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.572 0.582 . . . . 70.14 112.572 -177.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.35 109.29 2.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.163 0.506 . . . . 71.32 111.369 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.2 tp -49.19 -55.51 12.24 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.31 0.855 . . . . 62.24 113.31 -174.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.3 69.17 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.311 0.486 . . . . 65.21 112.311 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.65 67.95 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.928 0.394 . . . . 74.22 111.046 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.455 ' CD1' HD22 ' A' ' 42' ' ' LEU . 64.5 t80 -53.6 -52.05 61.07 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.896 -0.593 . . . . 61.5 111.0 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -69.38 -54.21 15.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.761 -0.654 . . . . 70.41 111.983 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -55.91 -46.74 78.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.374 0.509 . . . . 63.13 112.374 -174.167 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.57 -54.7 11.04 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.887 0.329 . . . . 71.43 111.887 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.6 tp -55.91 -39.27 71.38 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.848 0.356 . . . . 70.14 111.508 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.09 -39.61 95.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.56 -0.291 . . . . 75.31 111.506 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -68.81 -41.56 78.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.725 0.298 . . . . 64.41 111.313 177.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 87.7 mmm -59.99 -47.61 85.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.001 0.429 . . . . 73.13 110.949 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.48 -44.64 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-N 116.203 -0.453 . . . . 63.33 110.978 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -49.62 -50.7 41.9 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.261 0.624 . . . . 74.13 111.964 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.554 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 2.8 mp0 -70.96 -41.21 71.39 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.31 -0.405 . . . . 75.43 111.739 178.185 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -33.62 74.34 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.34 0.496 . . . . 33.52 112.34 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -28.86 69.54 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.03 0.382 . . . . 62.11 112.03 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HE3' ' HA ' ' A' ' 25' ' ' GLN . 10.4 mtmp? -70.22 -13.94 62.4 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.063 0.458 . . . . 75.13 111.147 175.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -120.28 -172.25 2.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.095 -0.502 . . . . 73.05 110.559 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -94.51 36.2 1.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.172 0.51 . . . . 72.03 110.888 174.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.12 122.71 5.84 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-N 116.232 -0.44 . . . . 73.43 113.867 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.1 m -87.71 118.0 26.92 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.571 -0.37 . . . . 73.44 110.632 175.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.2 t -105.1 137.57 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.247 0.546 . . . . 72.43 112.291 -175.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 t -152.17 167.67 27.79 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.75 -0.659 . . . . 70.14 110.297 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -156.16 158.18 37.21 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.361 0.601 . . . . 75.13 112.345 -175.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 t -132.71 133.64 43.76 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.844 -0.616 . . . . 64.54 110.846 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.23 138.39 34.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.057 0.456 . . . . 73.35 111.814 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -143.44 89.6 2.09 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.223 0.535 . . . . 70.22 110.555 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.74 -99.34 0.47 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.13 -0.486 . . . . 42.21 112.503 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -114.14 12.8 17.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 120.883 0.373 . . . . 73.41 111.243 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -104.26 130.24 52.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.815 0.341 . . . . 55.12 111.26 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.455 HD22 ' CD1' ' A' ' 15' ' ' PHE . 47.8 tp -120.67 96.35 5.09 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.321 -0.4 . . . . 71.14 111.279 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -87.64 109.11 19.43 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.808 0.337 . . . . 70.44 110.832 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.7 mt -101.74 115.21 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 120.83 0.348 . . . . 72.33 111.925 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HD2' ' OG1' ' A' ' 47' ' ' THR . 0.8 OUTLIER -95.45 121.26 36.94 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.189 0.519 . . . . 65.44 111.146 175.938 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.476 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 47.1 mt -121.18 113.59 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.701 173.251 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.536 ' OG1' ' HD2' ' A' ' 45' ' ' ARG . 63.7 m -105.39 133.69 49.73 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.732 0.301 . . . . 55.22 111.365 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.84 -10.69 18.37 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.899 -0.667 . . . . 63.22 113.747 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.461 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 22.5 m -63.49 133.9 95.67 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 116.926 0.363 . . . . 74.43 111.689 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 14.3 Cg_exo -69.34 147.64 66.04 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.757 2.305 . . . . 73.32 113.616 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -46.68 -52.7 13.24 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.814 -0.63 . . . . 64.44 112.46 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -58.94 -29.88 67.45 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.487 0.551 . . . . 74.13 112.487 -177.065 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.541 HG12 ' HG ' ' A' ' 57' ' ' LEU . 42.6 t -79.29 -16.13 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 120.789 0.328 . . . . 52.44 111.652 -176.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB2' ' A' ' 58' ' ' ALA . 46.0 tpt85 -46.63 -37.87 8.82 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.104 0.562 . . . . 75.35 111.917 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -65.91 -54.86 21.04 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.472 -0.785 . . . . 74.5 111.94 -177.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -64.28 -37.18 86.59 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.959 0.355 . . . . 54.52 111.959 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.541 ' HG ' HG12 ' A' ' 53' ' ' VAL . 95.9 mt -60.34 -45.09 94.69 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.865 0.364 . . . . 61.42 111.458 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . . . -63.78 -45.65 88.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.103 0.478 . . . . 63.24 111.462 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -64.29 -31.76 73.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.035 -0.53 . . . . 54.45 111.316 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -72.69 -48.53 38.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.309 -0.405 . . . . 53.44 111.017 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.73 -42.32 71.43 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.22 0.452 . . . . 72.15 112.22 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.23 -48.7 78.14 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.734 0.302 . . . . 72.14 111.47 176.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -63.13 -37.07 85.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.272 -0.422 . . . . 73.4 110.823 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.66 -43.6 96.25 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.99 0.424 . . . . 65.23 111.612 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.06 14.43 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.18 0.437 . . . . 70.01 112.18 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -62.47 -30.7 71.44 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.033 0.382 . . . . 73.1 112.033 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -53.56 -39.5 64.82 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.837 0.351 . . . . 71.21 111.229 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -112.24 12.65 20.37 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 111.855 0.317 . . . . 73.22 111.855 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.3 t30 59.75 23.86 12.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.241 0.543 . . . . 55.52 111.898 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 32.1 pt -93.5 170.16 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.829 -0.544 . . . . 75.34 111.45 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.7 m -94.84 148.26 22.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 116.531 -0.304 . . . . 75.33 111.713 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 13.6 p -146.72 133.25 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 120.996 0.427 . . . . 33.14 111.997 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.6 p -132.67 167.6 19.79 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 122.161 -0.337 . . . . 51.25 110.988 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -125.35 146.23 49.67 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.948 0.404 . . . . 52.22 111.908 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 99.0 m -140.22 122.82 16.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.269 -0.423 . . . . 65.14 110.654 174.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 3' ' ' MET . 66.0 mt -134.2 132.12 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 112.031 0.382 . . . . 51.05 112.031 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.3 mtm180 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 109.839 -0.43 . . . . 75.13 109.839 172.563 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.946 0.403 . . . . 72.32 110.711 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 2.3 tm-20 -137.49 130.99 31.19 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.926 -0.398 . . . . 64.45 109.926 -175.35 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.546 ' SD ' HG13 ' A' ' 76' ' ' ILE . 12.8 tpt -115.89 120.3 38.77 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.955 1.095 . . . . 74.41 113.955 -161.388 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -97.87 120.67 38.67 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 116.471 -0.331 . . . . 64.43 110.777 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.414 HG13 ' HG3' ' A' ' 3' ' ' MET . 62.7 mt -127.07 140.04 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-O 120.822 0.344 . . . . 64.44 111.028 177.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.42 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 67.0 mtt85 -137.89 121.7 17.6 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.951 -0.468 . . . . 74.1 112.001 -178.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.417 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 75.8 m-85 -100.33 144.9 28.79 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.94 0.4 . . . . 64.42 111.61 178.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 43.7 ttm180 -143.06 131.48 22.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.388 -0.369 . . . . 65.42 110.613 174.514 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 168.53 -145.94 9.98 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 119.845 -1.169 . . . . 73.21 114.355 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 28.3 t70 -139.36 174.14 10.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 122.528 0.331 . . . . 72.2 111.138 -175.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.434 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 26.8 t70 84.89 137.11 0.05 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 74.13 112.103 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.8 -49.07 61.63 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.013 -0.54 . . . . 73.32 111.743 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.57 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 44.8 mt-10 -59.95 -34.35 73.14 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.609 0.242 . . . . 72.53 111.227 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.75 -44.4 69.93 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.933 0.397 . . . . 72.2 110.734 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.78 -60.28 3.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.213 -0.449 . . . . 74.11 111.912 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 9.3 pt-20 -65.36 -41.86 93.4 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.647 0.61 . . . . 75.41 112.647 -172.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -71.69 -46.58 58.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.219 -0.301 . . . . 73.43 111.6 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -61.17 -48.93 79.28 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.86 0.362 . . . . 73.45 111.027 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 23' ' ' ILE . 59.6 tp -58.33 -44.14 88.53 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.436 -0.347 . . . . 64.45 110.908 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.05 -47.75 80.19 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.476 -0.329 . . . . 71.12 111.68 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 21.9 mm-40 -58.94 -38.7 79.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.821 0.343 . . . . 54.43 111.592 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 86.9 mmm -67.64 -37.94 83.13 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.675 0.274 . . . . 74.02 111.036 176.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 19' ' ' LEU . 76.4 mt -64.7 -40.16 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.1 0.476 . . . . 65.42 110.569 174.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -57.57 -41.7 81.61 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.204 0.526 . . . . 74.1 110.663 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 21' ' ' GLU . 68.2 mt-30 -66.06 -45.16 82.31 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.149 -0.478 . . . . 73.54 110.636 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.44 ' HB2' HG21 ' A' ' 33' ' ' VAL . . . -55.97 -34.42 65.71 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.763 -0.653 . . . . 65.05 112.701 -178.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 10.3 mmm180 -63.13 -29.21 70.62 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.834 0.349 . . . . 71.25 111.422 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -79.81 -18.33 51.18 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.058 0.392 . . . . 55.23 112.058 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -94.38 125.42 39.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.964 0.411 . . . . 52.53 111.704 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.06 59.17 2.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.181 0.515 . . . . 43.15 111.223 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.78 -136.88 2.59 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 115.99 -0.55 . . . . 62.25 113.05 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.1 m -142.68 139.21 31.08 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.919 0.34 . . . . 73.1 111.919 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.555 HG22 HG23 ' A' ' 46' ' ' ILE . 98.3 t -121.65 137.1 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 121.013 0.435 . . . . 70.34 111.608 178.272 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.3 p -117.58 150.84 38.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.052 -0.522 . . . . 63.1 111.003 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.651 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.9 p90 -155.88 131.95 9.99 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.203 0.525 . . . . 64.13 112.383 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 t -137.29 139.62 41.03 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.16 -0.473 . . . . 72.23 111.465 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.1 140.67 29.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.904 0.383 . . . . 64.23 111.788 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -141.81 86.95 2.02 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.157 0.503 . . . . 73.24 110.6 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.98 -94.93 0.15 Allowed Glycine 0 CA--C 1.524 0.649 0 CA-C-N 116.19 -0.459 . . . . 65.54 112.972 -178.153 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -107.68 -7.34 16.45 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.754 0.312 . . . . 74.11 111.116 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -93.71 150.92 20.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.244 0.545 . . . . 71.41 111.812 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' HG13 ' A' ' 44' ' ' ILE . 29.8 tp -138.39 102.21 4.57 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.846 -0.616 . . . . 71.25 110.898 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.651 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 36.3 mm-40 -78.18 111.23 13.9 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.027 -0.533 . . . . 63.51 111.026 178.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.435 HG13 ' HG ' ' A' ' 42' ' ' LEU . 62.8 mt -122.03 109.79 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.053 0.454 . . . . 74.42 111.24 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -112.71 127.16 56.05 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.993 0.425 . . . . 65.03 110.995 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.555 HG23 HG22 ' A' ' 33' ' ' VAL . 54.7 mt -111.34 109.77 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.092 0.473 . . . . 74.53 111.047 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 89.4 m -98.68 109.26 22.04 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.083 -0.508 . . . . 72.55 111.546 -177.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.69 67.23 0.57 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 121.404 -0.427 . . . . 71.12 113.312 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 m -122.13 143.2 38.44 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 112.069 0.396 . . . . 72.31 112.069 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.35 146.25 44.78 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.752 2.302 . . . . 74.14 112.597 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -54.89 -46.92 74.85 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.916 0.389 . . . . 61.13 111.967 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.07 -22.06 60.16 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.463 0.542 . . . . 74.51 112.463 -177.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.47 HG12 ' HG ' ' A' ' 57' ' ' LEU . 48.6 t -85.92 -6.45 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-O 121.085 0.469 . . . . 60.21 111.488 -178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.439 ' HD3' HD12 ' A' ' 76' ' ' ILE . 47.6 tpt85 -50.28 -44.42 53.83 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 111.984 0.365 . . . . 64.44 111.984 176.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -63.5 -40.72 97.82 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.494 -0.321 . . . . 72.43 111.326 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.24 -51.89 61.39 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.358 -0.383 . . . . 73.13 111.169 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.47 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.3 mt -53.16 -49.37 66.78 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.876 0.37 . . . . 74.3 111.811 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.75 -51.12 52.83 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.999 0.428 . . . . 44.04 111.822 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -58.43 -42.63 87.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.955 -0.566 . . . . 72.42 112.257 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.633 ' HG3' HH21 ' A' ' 63' ' ' ARG . 0.4 OUTLIER -70.43 -43.29 70.25 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.235 -0.439 . . . . 73.44 111.783 178.865 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.88 82.69 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.042 0.449 . . . . 74.42 111.314 176.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 45.1 mt-10 -61.66 -43.64 98.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.265 -0.425 . . . . 65.23 111.112 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.633 HH21 ' HG3' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -55.97 -44.16 78.25 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.883 0.373 . . . . 72.23 111.227 176.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 96.2 mt -60.32 -48.87 79.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.0 0.429 . . . . 73.33 111.09 176.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.59 -52.33 65.87 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.151 -0.477 . . . . 72.1 112.023 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.488 ' NZ ' ' HB3' ' A' ' 66' ' ' LYS . 7.7 mtpm? -61.63 -44.67 96.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.28 -0.418 . . . . 74.2 112.033 -177.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.0 -34.2 73.01 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 120.83 0.348 . . . . 51.31 111.898 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.1 7.76 36.37 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.259 0.466 . . . . 73.41 112.259 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 58.68 30.98 20.65 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.468 0.544 . . . . 74.02 112.468 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.6 pt -109.6 177.13 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.009 0.433 . . . . 64.53 111.728 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.433 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 55.4 p -102.62 153.4 20.14 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.119 0.485 . . . . 72.02 111.921 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -152.11 141.56 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.128 0.489 . . . . 74.35 111.628 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 74.4 p -118.55 141.21 48.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.253 -0.43 . . . . 54.43 110.079 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.409 ' HB2' ' HE3' ' A' ' 3' ' ' MET . 21.6 p90 -140.86 120.06 12.93 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.55 -0.296 . . . . 71.43 111.002 -176.363 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.0 m -153.58 116.71 4.56 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.446 0.535 . . . . 72.34 112.446 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 ' SD ' ' A' ' 3' ' ' MET . 29.1 mt -76.96 141.76 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.491 -0.322 . . . . 71.42 110.408 171.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 122.066 0.936 . . . . 65.43 110.999 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttp . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.475 0.178 . . . . 74.53 110.553 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -124.38 164.08 20.41 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.971 0.415 . . . . 52.05 111.373 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt -148.43 118.84 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.789 0.328 . . . . 61.15 111.828 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 37.0 m-20 -94.81 104.77 16.68 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.779 0.324 . . . . 65.31 111.487 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.1 mt -105.12 146.45 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 122.33 0.252 . . . . 73.42 110.518 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.497 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 5.9 ptm180 -144.16 118.25 9.47 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.509 0.671 . . . . 75.24 111.882 175.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -90.41 149.88 22.08 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.774 -0.648 . . . . 64.32 110.331 174.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -141.74 120.38 12.55 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.701 0.286 . . . . 72.33 110.431 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.12 -164.83 36.21 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 121.065 -0.588 . . . . 53.13 113.143 -177.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -118.37 -24.48 6.85 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.21 0.448 . . . . 73.15 112.21 -176.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.9 118.32 6.55 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.562 . . . . 71.34 112.516 -173.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -67.59 -43.59 80.17 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.067 -0.515 . . . . 71.52 111.741 -178.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 3.5 mp0 -53.97 -30.63 47.78 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.0 0.371 . . . . 62.42 112.0 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.22 -40.36 70.75 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.488 -0.324 . . . . 61.1 111.713 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.474 ' O ' ' HB3' ' A' ' 19' ' ' LEU . 84.3 t80 -53.42 -57.23 11.37 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.306 -0.406 . . . . 71.42 111.429 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -65.38 -57.22 8.88 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.83 0.348 . . . . 74.24 111.625 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 72.8 mmtt -59.77 -47.34 86.07 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.383 0.512 . . . . 74.33 112.383 -170.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.429 ' HB1' HD13 ' A' ' 64' ' ' LEU . . . -75.0 -58.71 3.12 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.547 0.573 . . . . 62.12 112.547 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.474 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 67.7 tp -61.86 -53.29 57.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.194 0.442 . . . . 73.02 112.194 -173.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -60.56 -33.27 72.45 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.15 0.5 . . . . 74.14 110.755 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.503 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 16.1 tp10 -66.78 -44.2 81.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.33 0.652 . . . . 64.12 111.029 176.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.53 -44.61 90.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.994 0.425 . . . . 71.24 111.315 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.554 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.0 mt -61.15 -39.7 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.905 0.383 . . . . 75.55 110.782 175.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 52.3 ttt180 -49.38 -53.84 20.4 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.933 -0.576 . . . . 64.14 111.421 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.495 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 2.8 mp0 -61.04 -42.64 98.86 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.856 0.36 . . . . 64.34 111.273 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.37 -25.33 64.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.059 0.392 . . . . 74.44 112.059 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 3.9 mmp_? -77.96 -30.01 50.12 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.733 0.301 . . . . 74.43 111.529 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 25' ' ' GLN . 54.1 mtmt -75.21 -35.84 61.45 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.015 0.436 . . . . 73.33 110.863 175.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -90.4 -173.38 3.77 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.291 -0.413 . . . . 73.4 110.851 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.38 10.73 38.86 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.058 -0.401 . . . . 65.03 111.848 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -84.33 170.36 46.7 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 121.129 -0.558 . . . . 74.51 113.457 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 85.7 m -134.22 136.22 43.53 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.428 -0.454 . . . . 74.32 111.3 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 95.4 t -109.92 123.92 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.0 0.429 . . . . 73.23 111.973 -178.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 t -117.15 158.93 23.4 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.442 -0.345 . . . . 54.33 110.664 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -155.07 143.8 20.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.928 0.394 . . . . 54.54 112.035 -174.214 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -126.6 129.94 49.53 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.001 0.429 . . . . 65.41 111.419 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.439 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.0 mm? -89.68 133.62 34.56 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.269 -0.423 . . . . 71.34 111.069 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 12.1 t70 -138.3 81.02 1.83 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.349 -0.387 . . . . 72.4 110.488 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.51 -85.79 0.03 OUTLIER Glycine 0 CA--C 1.532 1.103 0 C-N-CA 121.428 -0.415 . . . . 72.14 113.634 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -117.0 9.43 13.68 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.989 0.423 . . . . 71.24 111.504 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 38' ' ' ASP . 5.8 m-20 -112.66 128.75 56.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.295 -0.411 . . . . 74.31 111.553 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.46 95.61 5.04 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.112 0.482 . . . . 75.3 110.331 174.318 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.497 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 32.4 mt-10 -93.5 112.15 23.98 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.261 0.553 . . . . 74.01 111.576 -176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.9 mt -109.38 111.73 37.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-N 115.752 -0.658 . . . . 72.51 111.988 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.491 HH12 ' HD2' ' A' ' 77' ' ' ARG . 51.4 ttt85 -101.85 128.18 48.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.903 0.383 . . . . 74.35 111.315 178.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 49.3 mt -111.29 130.73 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 121.128 0.489 . . . . 74.25 111.586 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.7 m -121.08 141.01 51.19 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.246 -0.434 . . . . 63.04 111.533 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.23 46.16 5.09 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 121.247 -0.501 . . . . 51.14 113.59 177.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.8 m -125.31 139.23 33.34 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.539 -0.389 . . . . 70.55 111.539 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.42 168.86 16.13 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.807 2.338 . . . . 73.35 113.033 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.52 -48.63 74.36 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.57 0.581 . . . . 71.3 112.57 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.435 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.8 pt20 -59.72 -42.45 93.14 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.386 0.513 . . . . 71.25 112.386 -176.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 52' ' ' GLN . 90.0 t -76.97 -30.91 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 120.686 0.279 . . . . 74.35 111.496 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.85 -46.0 78.3 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.663 0.268 . . . . 75.32 110.576 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -57.16 -43.25 82.37 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.018 0.437 . . . . 71.21 111.304 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.02 -40.55 96.59 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.076 0.465 . . . . 74.22 111.293 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.91 -41.73 97.6 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.402 -0.363 . . . . 62.02 111.171 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.29 88.41 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.123 0.487 . . . . 71.42 111.217 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -55.61 -38.2 69.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.707 -0.679 . . . . 64.22 111.029 177.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.506 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 8.9 tp10 -70.35 -52.22 24.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.02 -0.536 . . . . 71.33 110.841 176.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.487 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -52.35 -51.44 58.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.765 0.654 . . . . 72.44 112.765 -176.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.47 -37.09 72.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.958 0.408 . . . . 75.43 111.416 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -39.28 68.98 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.344 -0.389 . . . . 62.13 111.394 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 94.4 mt -56.84 -45.51 82.32 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.999 0.428 . . . . 52.52 111.184 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -64.2 -50.71 67.02 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.148 -0.478 . . . . 54.51 111.478 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.55 ' NZ ' ' HB3' ' A' ' 66' ' ' LYS . 3.3 mmmp? -52.14 -44.3 64.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.119 -0.492 . . . . 74.24 112.193 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.15 -24.41 67.15 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.123 0.416 . . . . 75.21 112.123 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -114.86 10.75 16.5 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.761 0.315 . . . . 55.24 111.757 176.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m120 62.03 16.06 7.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.992 0.738 . . . . 64.53 112.992 177.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.434 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 30.4 pt -92.27 165.71 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-O 121.107 0.48 . . . . 73.1 111.953 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.4 m -89.57 148.4 23.39 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.342 -0.39 . . . . 75.44 111.338 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.26 134.49 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.099 0.476 . . . . 52.43 111.745 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.2 p -131.6 155.75 46.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.164 -0.471 . . . . 71.41 110.066 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -146.07 128.87 16.29 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.45 0.643 . . . . 62.14 112.624 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.3 m -100.55 136.13 40.91 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.732 -0.667 . . . . 64.05 110.615 176.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.2 mm -102.21 135.62 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.644 0.259 . . . . 72.05 111.307 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HD2' HH12 ' A' ' 45' ' ' ARG . 7.9 ptp180 . . . . . 0 N--CA 1.47 0.547 0 CA-C-O 121.304 0.573 . . . . 72.44 111.555 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttp . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.905 0.383 . . . . 73.12 111.427 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.458 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 35.7 mt-10 -84.86 169.55 14.01 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.646 0.26 . . . . 64.25 110.747 174.09 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.506 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 23.9 ttt -127.41 107.23 9.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.693 0.282 . . . . 65.14 111.585 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.567 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 5.1 m-20 -93.38 128.28 39.36 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.078 -0.51 . . . . 60.32 111.268 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.6 mt -136.57 146.29 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.403 0.281 . . . . 50.01 111.054 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.442 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 98.3 mtt180 -131.69 110.4 10.87 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 122.081 -0.387 . . . . 75.01 111.676 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -89.75 131.93 35.46 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.085 -0.507 . . . . 75.53 110.999 176.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -135.34 129.13 32.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.351 -0.218 . . . . 75.11 110.552 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.85 -158.22 9.56 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 120.462 -0.875 . . . . 43.43 114.394 -176.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.28 13.94 19.21 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.761 0.652 . . . . 53.1 112.761 -175.465 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -143.9 150.28 38.17 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.24 0.543 . . . . 64.11 112.395 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.0 tp -77.02 -57.83 3.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.583 -0.735 . . . . 74.02 111.579 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 33.1 mt-10 -62.9 -27.14 69.16 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.122 0.416 . . . . 71.13 112.122 -176.351 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.7 68.74 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.874 0.369 . . . . 64.33 110.942 174.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.433 ' HB3' HD22 ' A' ' 42' ' ' LEU . 25.1 m-85 -64.02 -41.55 97.41 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.115 0.483 . . . . 72.23 110.821 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.69 -33.16 74.35 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.81 -0.632 . . . . 42.01 111.497 -177.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 11.0 mmpt? -64.37 -52.77 56.62 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.214 0.53 . . . . 75.12 110.246 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.49 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.8 -46.73 86.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.832 -0.622 . . . . 73.33 111.188 177.472 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -55.52 -47.21 76.61 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.844 -0.616 . . . . 64.23 111.436 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -60.53 -43.85 96.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.233 -0.439 . . . . 63.32 111.488 -177.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.56 -42.74 98.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.438 -0.346 . . . . 73.43 111.659 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.439 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 94.8 mmm -62.32 -44.37 96.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.673 -0.239 . . . . 75.3 111.364 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 74.8 mt -64.53 -45.84 94.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 120.784 0.326 . . . . 74.21 111.089 176.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.9 ttp85 -54.29 -43.97 71.53 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.111 0.481 . . . . 53.44 111.332 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -74.07 -39.84 63.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.739 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ALA . . . . . 0.46 ' HA ' ' HD2' ' A' ' 29' ' ' PHE . . . -59.76 -29.69 68.34 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.342 0.497 . . . . 60.54 112.342 -177.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.8 mtp180 -56.81 -28.38 61.4 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.11 0.411 . . . . 64.42 112.11 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.2 -26.98 67.64 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 111.958 0.355 . . . . 75.12 111.958 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.46 ' HD2' ' HA ' ' A' ' 26' ' ' ALA . 44.9 m-85 -92.77 142.91 26.82 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 75.04 111.646 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.67 77.5 6.28 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.159 0.504 . . . . 41.24 110.941 176.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -154.47 -155.99 7.5 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 120.886 -0.673 . . . . 41.32 113.934 -177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -128.57 139.72 52.15 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 122.648 -0.325 . . . . 71.42 111.408 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -114.61 130.29 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.794 0.331 . . . . 75.32 111.303 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 t -145.29 154.24 42.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.798 0.332 . . . . 61.41 111.679 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -156.38 161.79 40.1 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.108 0.48 . . . . 74.51 112.162 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.7 t -137.36 141.89 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.117 -0.492 . . . . 52.42 110.765 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.9 tp -121.39 128.33 52.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.949 0.404 . . . . 75.23 111.832 -176.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -127.63 84.67 2.27 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.144 0.497 . . . . 64.12 110.386 173.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.04 -101.0 0.38 Allowed Glycine 0 CA--C 1.528 0.868 0 CA-C-N 115.66 -0.7 . . . . 64.02 114.258 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -94.89 11.46 31.64 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.786 0.662 . . . . 73.24 112.786 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -145.04 133.38 21.75 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.968 0.413 . . . . 72.33 111.522 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.433 HD22 ' HB3' ' A' ' 15' ' ' PHE . 65.5 tp -122.35 117.39 25.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.399 . . . . 74.45 111.902 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -94.6 118.6 31.95 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.863 0.363 . . . . 71.41 111.253 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 46.5 mt -118.59 126.68 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.735 0.414 . . . . 75.44 110.761 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 3' ' ' MET . 39.9 ttp180 -125.15 121.09 33.19 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.952 0.405 . . . . 74.51 111.566 177.162 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.43 119.56 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.114 0.483 . . . . 73.51 110.843 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.458 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 59.2 m -92.35 112.49 24.46 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.946 -0.57 . . . . 74.01 111.913 -176.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.5 68.96 0.86 Allowed Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.241 -0.504 . . . . 62.21 113.571 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -126.3 130.32 23.96 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 120.799 0.333 . . . . 51.42 111.477 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.49 155.41 31.96 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.041 2.494 . . . . 74.01 114.153 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -66.67 -41.68 87.77 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.823 -0.626 . . . . 71.25 112.437 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.485 ' HG3' HG23 ' A' ' 53' ' ' VAL . 11.4 pt20 -59.23 -26.63 65.04 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.132 0.419 . . . . 70.13 112.132 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.485 HG23 ' HG3' ' A' ' 52' ' ' GLN . 38.3 t -98.4 -5.38 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-O 120.992 0.425 . . . . 70.31 111.642 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.506 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 18.1 tpp180 -53.07 -40.7 64.23 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 122.214 -0.303 . . . . 71.12 111.048 178.531 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -50.93 -50.78 57.03 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.179 0.514 . . . . 71.41 111.5 177.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -66.73 -54.26 24.7 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.657 -0.701 . . . . 64.21 111.486 -176.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.97 -46.97 81.82 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.052 -0.522 . . . . 71.52 111.905 -178.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.93 76.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.876 0.369 . . . . 65.23 111.606 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -76.19 -36.42 58.65 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.908 0.385 . . . . 72.12 111.323 -179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -63.65 -45.37 90.5 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.921 0.391 . . . . 73.43 111.294 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -60.38 -35.3 75.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.385 -0.37 . . . . 43.42 111.575 177.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 23.0 mm-40 -55.23 -49.29 72.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.845 0.355 . . . . 63.05 110.15 172.144 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 20.9 ttm-85 -56.06 -53.22 59.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.11 -0.495 . . . . 71.31 110.594 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 61' ' ' ALA . 88.5 mt -48.8 -46.85 42.3 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.714 -0.675 . . . . 71.52 112.18 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.18 88.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.31 -0.405 . . . . 73.51 111.781 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 32.2 mmtp -72.36 -35.12 68.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.506 0.558 . . . . 72.43 112.506 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 13.6 mm-40 -54.27 -41.42 68.83 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.051 0.453 . . . . 74.21 111.353 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -103.37 1.43 32.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.335 -0.393 . . . . 71.1 111.498 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.1 m120 54.24 42.32 31.56 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.488 0.661 . . . . 54.11 111.591 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 35.3 pt -103.74 169.3 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.589 -0.732 . . . . 72.05 111.308 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.6 m -87.71 148.97 24.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.64 0.257 . . . . 62.51 111.645 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.27 136.17 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.105 0.479 . . . . 73.41 112.051 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 73.6 p -118.22 146.47 44.22 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.429 -0.351 . . . . 72.2 111.179 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -122.93 137.65 54.89 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.117 0.484 . . . . 75.42 112.225 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 97.6 m -136.34 105.44 5.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.012 -0.54 . . . . 55.24 109.972 173.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.405 ' CD1' ' HG3' ' A' ' 3' ' ' MET . 42.7 mm -101.29 105.48 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 122.26 -0.275 . . . . 64.51 110.987 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 18.3 ptp180 . . . . . 0 CA--C 1.544 0.713 0 CA-C-O 121.629 0.728 . . . . 65.23 111.249 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.419 ' C ' HH22 ' A' ' 54' ' ' ARG . 47.3 ttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.658 0.266 . . . . 74.25 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -117.27 155.74 28.96 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.01 0.374 . . . . 72.41 112.01 -172.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.631 ' HB3' ' NH1' ' A' ' 54' ' ' ARG . 21.8 ptm -149.59 142.36 24.64 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.338 0.495 . . . . 75.04 112.338 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -112.67 118.36 34.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 122.602 0.361 . . . . 72.13 111.518 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.1 mt -115.96 114.54 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 120.612 0.244 . . . . 71.01 110.862 175.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.456 ' HD2' ' N ' ' A' ' 6' ' ' ARG . 3.5 mpt_? -109.02 121.59 45.46 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.938 0.399 . . . . 75.04 111.809 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.571 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 88.4 m-85 -94.34 150.18 20.53 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.258 -0.428 . . . . 73.54 110.922 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 17.2 tpt180 -142.39 120.42 12.1 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.276 -0.42 . . . . 65.12 110.878 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.544 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -178.59 -179.35 48.41 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.978 -0.63 . . . . 71.13 113.108 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -108.49 -17.47 13.97 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.517 0.562 . . . . 61.33 112.517 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.38 110.18 7.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.027 0.441 . . . . 71.01 110.898 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 50.6 tp -62.38 -41.73 98.86 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.232 0.456 . . . . 65.31 112.232 -175.543 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -66.37 -35.03 79.31 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.577 0.227 . . . . 61.1 111.51 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.6 70.86 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.464 -0.334 . . . . 73.23 111.691 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -56.18 -51.77 66.82 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.651 -0.249 . . . . 74.33 111.403 177.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.26 -45.24 85.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.736 0.303 . . . . 71.45 111.439 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -57.83 -38.77 76.19 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.805 0.336 . . . . 72.12 111.804 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.551 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -73.96 -53.14 10.75 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.407 0.623 . . . . 73.24 111.234 177.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -60.07 -46.1 90.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.628 -0.715 . . . . 65.14 112.525 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -58.6 -40.0 81.99 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.776 0.43 . . . . 75.32 111.646 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -73.58 -38.83 65.04 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.889 0.376 . . . . 75.03 111.198 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 97.1 mmm -58.27 -46.58 85.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.066 0.46 . . . . 74.25 110.452 174.174 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 69.0 mt -64.63 -39.36 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.048 -0.524 . . . . 65.33 111.004 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 8.9 tpt180 -53.62 -50.11 66.39 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.855 0.36 . . . . 74.15 111.044 177.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -67.1 -48.78 67.12 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.397 -0.365 . . . . 61.21 111.13 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.84 -34.08 67.42 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.685 0.624 . . . . 71.13 112.685 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -59.21 -27.74 66.0 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.024 0.379 . . . . 75.41 112.024 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -76.62 -18.26 58.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.816 0.341 . . . . 62.15 111.875 178.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -108.33 143.79 36.74 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.079 0.466 . . . . 74.4 111.679 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.3 89.6 5.52 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.077 0.465 . . . . 71.32 111.759 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -155.97 -155.53 7.42 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.246 -0.502 . . . . 73.12 112.975 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.3 m -137.73 131.29 31.1 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.519 -0.401 . . . . 63.12 111.258 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.437 HG22 HG23 ' A' ' 46' ' ' ILE . 88.8 t -124.81 118.62 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.844 0.355 . . . . 74.34 111.264 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 45' ' ' ARG . 30.3 p -107.41 129.76 54.89 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.531 -0.304 . . . . 71.22 111.007 179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 52.7 p90 -133.0 142.74 49.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.349 0.5 . . . . 64.12 112.349 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 64.8 p -133.21 137.99 46.35 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.124 -0.489 . . . . 73.13 111.456 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.24 134.46 53.76 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.252 -0.431 . . . . 74.21 110.935 177.151 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -149.95 95.93 2.37 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.955 0.407 . . . . 42.51 111.396 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.66 -82.26 0.05 OUTLIER Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.263 -0.494 . . . . 75.34 113.532 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 78.9 m-20 -122.47 -3.65 8.85 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 122.489 -0.419 . . . . 75.01 112.014 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -101.95 134.99 44.29 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.992 0.425 . . . . 70.43 111.822 -177.399 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 22.9 tp -128.91 99.96 5.49 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.022 -0.536 . . . . 74.25 110.366 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 46.0 mt-10 -91.92 104.48 16.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 75.41 111.326 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.6 mt -102.14 128.8 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.223 -0.444 . . . . 65.35 110.409 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB3' ' OG1' ' A' ' 34' ' ' THR . 51.1 ttt180 -126.16 112.57 15.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.93 0.395 . . . . 72.14 110.475 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.437 HG23 HG22 ' A' ' 33' ' ' VAL . 52.7 mt -104.85 114.47 44.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-O 121.246 0.546 . . . . 73.2 111.531 -176.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.6 m -105.14 113.82 27.65 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.848 -0.615 . . . . 63.51 111.769 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.3 -43.54 1.28 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 120.599 -0.81 . . . . 62.1 114.515 174.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.57 HG23 HH21 ' A' ' 54' ' ' ARG . 17.6 m -50.7 128.8 26.89 Favored Pre-proline 0 N--CA 1.478 0.969 0 N-CA-C 113.833 1.049 . . . . 65.25 113.833 -172.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -85.42 -169.26 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.772 2.981 . . . . 75.02 114.277 -177.059 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -48.45 -72.02 0.06 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.582 0.956 . . . . 75.24 113.582 -176.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.472 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 24.2 pt20 -50.11 -34.41 21.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.754 0.65 . . . . 64.35 112.754 -174.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 t -80.23 -36.02 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 120.989 0.423 . . . . 60.55 111.447 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB3' ' A' ' 3' ' ' MET . 4.5 tpp180 -53.77 -52.78 59.11 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.85 -0.614 . . . . 74.21 112.016 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . 0.472 ' HE3' ' HA ' ' A' ' 52' ' ' GLN . 22.2 pttp -61.67 -34.68 76.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.091 -0.504 . . . . 54.44 111.951 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -71.53 -42.51 67.85 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.66 0.267 . . . . 74.15 111.617 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.436 HD11 HG11 ' A' ' 49' ' ' VAL . 86.6 mt -64.45 -45.35 87.84 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.945 0.402 . . . . 73.52 111.183 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.29 96.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.171 0.51 . . . . 71.3 111.203 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -63.77 -35.43 80.58 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.043 -0.526 . . . . 73.31 111.593 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -67.12 -42.56 84.3 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.915 0.388 . . . . 71.35 110.998 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.558 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -52.17 -40.84 62.02 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.082 -0.508 . . . . 65.4 112.058 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 35.0 mm-40 -61.74 -50.55 71.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.727 0.298 . . . . 72.15 111.682 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -55.45 -51.7 66.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.94 0.4 . . . . 74.05 111.101 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.551 HD22 ' HA ' ' A' ' 18' ' ' ALA . 83.4 mt -55.39 -41.28 72.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.745 -0.661 . . . . 32.11 111.465 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.533 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -64.68 -50.96 64.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.178 0.513 . . . . 34.5 112.256 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 10.5 mmpt? -63.19 -60.54 3.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.096 0.776 . . . . 61.34 113.096 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -75.44 -15.77 60.4 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.962 0.727 . . . . 72.15 112.962 -172.621 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' A' ' 64' ' ' LEU . 84.9 m-85 -100.6 8.57 43.34 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 122.079 -0.388 . . . . 72.31 111.973 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 60.46 35.75 20.28 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.584 0.587 . . . . 75.33 112.584 173.389 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.544 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.6 pt -126.06 149.38 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 121.184 0.516 . . . . 64.33 111.639 179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.7 m -86.97 139.59 30.44 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.403 -0.362 . . . . 62.23 110.735 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.558 HG21 ' HB1' ' A' ' 61' ' ' ALA . 14.5 p -126.22 122.1 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.547 0.689 . . . . 63.42 112.414 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 80.9 p -121.18 121.7 38.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.788 -0.642 . . . . 73.11 110.449 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -122.05 143.09 49.71 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.869 0.692 . . . . 75.44 112.869 -175.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 94.4 m -122.54 120.26 33.29 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.567 -0.742 . . . . 75.05 110.612 178.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -118.79 144.86 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.959 0.409 . . . . 70.3 111.451 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 77' ' ' ARG . 59.3 mmt-85 . . . . . 0 CA--C 1.534 0.362 0 CA-C-O 121.023 0.44 . . . . 74.32 111.513 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.643 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 49.4 ttp . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.044 0.45 . . . . 70.11 111.51 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.664 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 27.3 mt-10 -127.42 170.8 12.15 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.115 -0.493 . . . . 73.1 110.774 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.658 ' SD ' ' NH2' ' A' ' 54' ' ' ARG . 27.5 ttt -143.69 128.0 17.78 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.649 0.611 . . . . 65.21 112.649 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 6' ' ' ARG . 4.7 m-20 -82.72 128.86 34.77 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.665 -0.698 . . . . 54.35 110.222 171.729 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.7 mt -139.56 109.42 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.77 0.319 . . . . 74.55 111.146 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 43' ' ' GLU . 2.4 mpt_? -119.45 125.41 48.87 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 122.104 -0.373 . . . . 65.13 111.975 -179.339 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -109.11 145.56 35.49 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 116.26 -0.427 . . . . 73.0 111.498 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -142.5 120.09 11.77 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.316 -0.253 . . . . 73.5 110.316 172.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -148.73 159.68 28.12 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.649 -0.786 . . . . 52.4 113.693 -176.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.98 -13.02 34.17 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.148 0.425 . . . . 73.53 112.148 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.27 161.08 25.3 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.039 0.447 . . . . 65.31 111.933 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.3 tp -85.51 -58.51 2.64 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.948 0.404 . . . . 75.24 111.674 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 41.4 mt-10 -66.78 -30.25 70.41 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 111.979 0.363 . . . . 62.31 111.979 -175.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.2 -33.17 51.64 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.997 0.369 . . . . 64.01 111.997 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.425 ' CE1' HD11 ' A' ' 37' ' ' LEU . 77.4 t80 -59.68 -53.56 56.64 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.109 0.481 . . . . 72.43 111.213 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -73.78 -36.9 65.11 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.016 -0.538 . . . . 74.4 111.906 -176.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 75.2 mmtt -59.59 -54.21 49.12 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.948 0.404 . . . . 63.34 111.306 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.48 -47.76 84.74 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.255 -0.43 . . . . 70.44 111.724 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.32 -45.44 91.32 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.026 0.441 . . . . 64.21 111.55 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -64.07 -42.91 96.83 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.303 -0.408 . . . . 62.33 111.653 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -61.8 -46.51 89.23 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.103 0.408 . . . . 73.53 112.103 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 78.2 mmm -56.52 -44.8 81.14 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.845 0.355 . . . . 75.54 111.196 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.9 mt -66.13 -43.43 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 121.054 0.454 . . . . 71.53 110.936 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -53.02 -54.68 31.77 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.229 0.612 . . . . 73.33 112.017 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.07 -37.75 84.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.774 0.321 . . . . 73.01 111.512 176.674 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.24 -25.24 65.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.222 0.452 . . . . 71.41 112.222 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 11.8 mmm180 -56.59 -27.79 58.8 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.142 0.423 . . . . 65.14 112.142 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.429 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -61.96 -25.56 67.68 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 111.788 0.292 . . . . 72.13 111.788 178.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.444 ' CZ ' HG21 ' A' ' 53' ' ' VAL . 23.4 m-85 -118.06 171.73 7.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.449 0.642 . . . . 72.3 112.074 -173.761 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.16 90.52 3.96 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.047 -0.524 . . . . 75.03 110.574 173.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -152.17 164.7 30.58 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 120.975 -0.631 . . . . 52.0 113.355 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -95.95 123.26 39.47 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.777 0.322 . . . . 73.53 111.594 -177.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t -115.31 119.35 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 116.255 -0.429 . . . . 71.4 110.552 175.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -130.87 164.48 25.14 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.701 0.286 . . . . 64.54 111.426 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.9 p90 -155.23 146.97 23.25 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.007 0.432 . . . . 73.55 111.683 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . 0.557 HG23 ' HB3' ' A' ' 43' ' ' GLU . 0.7 OUTLIER -137.32 137.38 38.88 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.886 0.374 . . . . 74.14 111.406 178.395 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.425 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.4 130.47 34.64 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.914 0.388 . . . . 60.42 111.568 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.58 106.32 7.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.992 0.425 . . . . 75.15 110.878 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.47 -97.0 0.22 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 121.229 -0.51 . . . . 54.33 113.335 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -125.29 11.14 8.08 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.132 0.419 . . . . 63.4 112.132 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -132.67 158.96 40.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.353 0.597 . . . . 64.15 112.407 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 35' ' ' TYR . 64.0 tp -109.08 125.29 51.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.778 -0.647 . . . . 74.14 111.604 -177.012 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.696 ' HA ' ' HG3' ' A' ' 6' ' ' ARG . 1.5 tm-20 -101.87 108.37 19.82 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.269 -0.423 . . . . 71.34 110.471 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -108.6 139.78 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.08 0.466 . . . . 73.23 112.245 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -125.28 123.28 39.13 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.072 -0.513 . . . . 74.44 110.763 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.59 121.83 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.819 0.343 . . . . 73.44 111.45 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.531 HG23 ' HG2' ' A' ' 2' ' ' GLU . 86.2 m -121.86 126.74 49.41 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.28 -0.418 . . . . 74.2 111.601 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.15 55.32 0.51 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.238 -0.506 . . . . 52.02 113.941 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 24.7 m -133.58 144.37 51.82 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.356 -0.497 . . . . 74.25 111.783 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.83 162.83 10.53 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.909 2.406 . . . . 72.4 113.598 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.55 -37.06 84.64 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.361 0.504 . . . . 74.41 112.361 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -60.3 -18.53 50.07 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.736 0.643 . . . . 74.12 112.736 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.54 HG12 ' HG ' ' A' ' 57' ' ' LEU . 16.4 t -112.42 -2.68 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.397 0.617 . . . . 62.33 111.066 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.658 ' NH2' ' SD ' ' A' ' 3' ' ' MET . 5.3 tpm_? -52.59 -58.38 6.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.87 -0.604 . . . . 65.54 112.525 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -66.05 -33.34 75.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.036 -0.529 . . . . 74.15 111.625 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.85 -50.56 70.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.235 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HG ' HG12 ' A' ' 53' ' ' VAL . 98.7 mt -61.36 -38.48 87.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.931 0.396 . . . . 61.53 111.206 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.26 98.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.219 -0.446 . . . . 74.44 111.678 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 62' ' ' GLU . 22.0 ttmm -78.51 -32.73 48.26 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 120.903 0.383 . . . . 53.33 111.954 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ARG . 29.1 tt0 -64.16 -32.87 74.61 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.952 -0.467 . . . . 72.11 110.555 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.4 -38.41 74.25 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.372 -0.377 . . . . 73.15 110.845 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 43.5 mt-10 -59.64 -43.72 93.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.979 0.419 . . . . 72.13 110.574 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 33.8 ttm180 -54.95 -54.0 48.38 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.28 -0.418 . . . . 71.14 111.347 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 18' ' ' ALA . 93.5 mt -56.42 -39.19 72.65 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 75.32 111.687 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.14 -57.13 4.51 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.069 0.461 . . . . 73.23 111.938 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.82 -24.86 66.22 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.52 . . . . 74.23 112.403 -174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -61.18 -47.92 83.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.116 0.484 . . . . 72.45 110.587 179.211 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -104.27 8.68 36.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.152 -0.476 . . . . 62.21 111.396 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 60.96 24.92 14.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.494 0.553 . . . . 74.02 112.494 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.2 pt -87.77 166.43 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.006 0.431 . . . . 75.51 111.673 -177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.2 m -87.54 142.5 27.8 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.48 -0.327 . . . . 72.3 111.366 -178.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 14.6 p -143.62 134.97 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.135 0.493 . . . . 62.52 111.839 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -119.43 123.09 43.22 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.697 -0.483 . . . . 74.54 109.697 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 34.0 p90 -128.46 135.32 49.3 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.232 0.539 . . . . 65.51 111.829 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.405 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 86.6 m -133.39 148.55 51.82 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.888 -0.596 . . . . 61.24 110.781 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.9 mm -101.99 114.28 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.907 0.384 . . . . 74.12 111.196 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 13.7 mtp180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.177 0.436 . . . . 74.11 112.177 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 tmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.806 -0.442 . . . . 73.13 109.806 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -102.58 148.72 25.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.926 0.394 . . . . 73.32 111.469 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.7 ttt -124.36 124.44 42.37 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.146 0.498 . . . . 61.11 112.123 -176.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -106.12 115.34 30.06 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.967 -0.56 . . . . 64.24 110.798 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.2 mt -120.72 141.69 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.42 0.288 . . . . 63.41 111.089 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.473 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 26.4 mtm105 -144.37 122.63 12.26 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.153 0.427 . . . . 70.31 112.153 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 41' ' ' ASP . 95.8 m-85 -103.13 125.43 49.83 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.473 -0.33 . . . . 70.4 111.628 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.509 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 8.2 tpt180 -104.33 119.33 38.73 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.813 0.34 . . . . 75.24 110.616 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.43 146.63 9.64 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 121.235 -0.507 . . . . 74.43 113.029 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -94.28 3.07 55.73 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 122.461 -0.434 . . . . 62.22 112.111 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.08 134.27 37.75 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.089 0.471 . . . . 71.42 111.991 177.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -71.3 -52.76 17.07 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.218 -0.446 . . . . 44.3 111.606 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.29 -31.2 67.26 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.783 0.325 . . . . 65.21 111.792 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.97 -40.14 69.73 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.518 -0.31 . . . . 73.44 111.69 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -56.64 -54.26 48.1 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.904 0.383 . . . . 64.44 111.333 176.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.02 -49.95 70.38 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.355 -0.384 . . . . 71.44 111.765 -178.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 70.3 mmtt -61.87 -54.57 40.29 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.331 0.493 . . . . 75.53 112.331 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.494 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -57.71 -48.55 79.24 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.82 0.343 . . . . 64.51 111.879 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.72 -44.68 92.87 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.856 0.36 . . . . 64.12 111.333 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -62.49 -46.01 90.39 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.966 0.358 . . . . 71.12 111.966 -177.236 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 25.7 mm-40 -64.82 -45.54 85.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.634 0.254 . . . . 75.14 111.557 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.6 mmt -55.8 -50.64 69.94 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.125 0.488 . . . . 72.53 111.017 176.671 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.559 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 64.9 mt -62.18 -42.47 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.269 -0.423 . . . . 73.45 111.429 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.7 ttm-85 -49.28 -48.12 46.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.108 0.48 . . . . 62.11 111.474 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -68.43 -46.08 70.84 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.939 -0.573 . . . . 75.42 111.829 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.37 -22.39 63.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.225 0.824 . . . . 52.32 113.225 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 37.1 mtp85 -56.68 -28.66 61.21 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 112.777 0.658 . . . . 65.15 112.777 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER -74.78 -20.95 59.58 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.969 0.359 . . . . 63.24 111.969 179.235 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -106.73 178.0 4.69 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.393 0.616 . . . . 62.13 112.181 -173.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -89.94 28.07 1.45 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.953 -0.567 . . . . 24.13 111.269 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.16 128.87 9.63 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 116.074 -0.512 . . . . 74.3 113.182 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 96.2 m -88.49 117.37 27.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.883 0.373 . . . . 73.43 111.026 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.495 HG22 HG12 ' A' ' 46' ' ' ILE . 77.1 t -103.41 109.79 28.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 120.996 0.427 . . . . 72.42 111.225 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.4 t -110.86 157.06 20.26 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.361 -0.381 . . . . 71.32 110.894 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.431 ' HB2' HD11 ' A' ' 42' ' ' LEU . 29.3 p90 -140.96 133.87 29.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.128 0.489 . . . . 75.12 112.1 -176.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 p -129.61 130.54 45.78 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.078 -0.51 . . . . 72.42 110.528 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -91.36 120.35 32.15 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.946 0.35 . . . . 52.54 111.946 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -113.25 88.97 2.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.941 0.4 . . . . 71.43 109.973 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.68 -101.2 0.23 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.167 -0.54 . . . . 70.32 113.558 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -109.03 13.21 24.76 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.584 -0.363 . . . . 62.21 111.669 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.465 ' HA ' ' O ' ' A' ' 7' ' ' PHE . 21.8 t70 -119.47 121.85 40.38 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.134 0.492 . . . . 74.42 110.654 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 35' ' ' TYR . 41.5 tp -94.47 106.84 18.83 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.194 -0.457 . . . . 73.21 110.897 178.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 6' ' ' ARG . 36.2 mt-10 -85.06 103.85 14.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.97 0.414 . . . . 70.3 111.068 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 113.2 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 120.984 0.421 . . . . 75.24 111.066 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -109.06 120.82 43.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.813 0.339 . . . . 64.42 111.154 -178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.495 HG12 HG22 ' A' ' 33' ' ' VAL . 53.4 mt -110.99 112.39 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 120.942 0.401 . . . . 74.43 111.214 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 73.0 m -107.01 132.49 52.88 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.186 0.439 . . . . 71.23 112.186 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.86 62.02 1.88 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.409 -0.424 . . . . 74.5 114.152 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 m -133.01 139.03 33.16 Favored Pre-proline 0 CA--C 1.545 0.773 0 O-C-N 122.481 -0.423 . . . . 52.41 111.944 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -58.05 132.61 50.44 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.738 2.292 . . . . 74.33 113.081 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -52.11 -36.4 50.94 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.076 0.769 . . . . 53.12 113.076 -174.109 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -67.2 -34.76 78.19 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 120.803 0.335 . . . . 73.45 111.871 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.2 t -75.21 -19.19 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 121.105 0.478 . . . . 62.4 111.185 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -50.6 -36.47 35.13 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.044 -0.526 . . . . 74.44 111.971 177.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -61.91 -43.08 99.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.702 -0.226 . . . . 73.33 111.496 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -64.61 -43.35 94.05 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.802 0.334 . . . . 72.34 111.121 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.8 -42.61 99.23 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.02 0.438 . . . . 74.42 111.05 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -67.87 -45.33 74.82 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 65.32 111.591 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -65.95 -32.82 74.53 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 75.13 111.427 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.59 -45.46 93.88 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.641 -0.503 . . . . 74.13 109.641 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.75 97.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.137 -0.483 . . . . 52.24 111.541 176.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-10 -55.54 -45.51 77.19 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.279 0.561 . . . . 74.01 110.533 175.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 63' ' ' ARG . 9.8 tpt180 -64.98 -49.51 69.99 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.584 -0.735 . . . . 74.21 111.412 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.494 HD22 ' HA ' ' A' ' 18' ' ' ALA . 91.8 mt -54.43 -45.2 72.97 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.029 0.381 . . . . 73.52 112.029 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.27 -56.72 15.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.807 0.337 . . . . 74.52 111.724 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -61.85 -35.75 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.147 0.425 . . . . 75.32 112.147 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.74 -34.94 73.61 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.03 0.443 . . . . 71.42 111.243 -178.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -105.71 0.04 25.9 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.349 -0.387 . . . . 72.31 111.553 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 61.17 21.62 12.04 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.113 0.565 . . . . 71.43 112.078 -177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 33.2 pt -86.92 175.34 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.015 0.436 . . . . 65.22 111.239 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 22.8 m -93.54 146.42 23.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.738 0.304 . . . . 73.11 111.318 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.2 p -137.6 139.57 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.148 0.499 . . . . 33.13 111.518 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.9 p -132.49 143.13 49.55 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.086 -0.507 . . . . 72.32 110.097 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -147.57 134.13 19.82 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.213 0.53 . . . . 74.12 111.916 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.3 p -121.08 145.0 48.25 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.957 -0.565 . . . . 71.34 110.822 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.7 mm -117.26 144.78 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.626 -0.261 . . . . 75.54 110.945 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 . . . . . 0 N--CA 1.467 0.376 0 CA-C-O 121.234 0.54 . . . . 73.22 111.66 175.458 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.0 mtp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.14 0.495 . . . . 74.53 111.558 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -133.43 147.4 51.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.005 -0.543 . . . . 72.14 109.586 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.457 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 28.6 ttt -148.88 118.99 7.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.092 0.775 . . . . 72.4 113.092 -173.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 6.5 m-20 -87.97 119.39 28.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.445 -0.343 . . . . 62.11 110.38 172.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 51.2 mt -116.33 108.4 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.032 0.444 . . . . 71.21 111.064 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.426 ' HG2' ' HB2' ' A' ' 43' ' ' GLU . 61.8 mtm-85 -98.56 102.1 13.74 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.575 0.583 . . . . 74.2 112.575 -176.225 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -85.78 143.24 28.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.454 -0.339 . . . . 73.23 110.305 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 43.9 ttt180 -141.47 118.88 11.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.564 0.221 . . . . 73.33 110.599 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.96 153.19 24.65 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.194 -0.527 . . . . 63.11 113.136 -176.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -97.49 -14.27 21.22 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.045 0.757 . . . . 64.23 113.045 -174.59 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . 0.444 ' CG ' ' H ' ' A' ' 12' ' ' LEU . 7.2 p-10 -72.66 -91.13 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 112.87 0.693 . . . . 75.31 112.87 -174.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.444 ' H ' ' CG ' ' A' ' 11' ' ' ASP . 57.9 tp 171.14 -51.82 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.145 0.578 . . . . 74.55 110.04 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 48.7 mt-10 -62.39 -29.93 70.84 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.652 -0.704 . . . . 54.04 111.687 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.71 -39.67 62.27 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.817 0.342 . . . . 75.32 111.383 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -62.47 -60.53 3.42 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.928 0.394 . . . . 61.41 111.574 176.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -63.12 -50.51 70.2 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.499 0.555 . . . . 71.33 112.499 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 65.0 mmtt -67.02 -46.1 75.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 111.742 0.275 . . . . 74.31 111.742 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -63.96 -46.21 85.7 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.781 0.324 . . . . 74.12 111.369 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.03 -47.23 78.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.017 0.437 . . . . 64.34 110.566 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -52.07 -55.92 17.66 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.704 -0.68 . . . . 74.13 112.166 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.89 -42.5 97.44 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.157 0.429 . . . . 73.21 112.157 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.429 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 77.6 mmm -61.94 -45.16 94.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.636 0.255 . . . . 74.42 111.294 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 66.7 mt -60.36 -40.45 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.733 0.302 . . . . 75.3 110.634 175.283 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -56.6 -41.98 77.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.866 0.365 . . . . 73.42 111.041 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -69.28 -42.87 74.94 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.059 0.457 . . . . 72.45 111.183 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.82 -35.52 81.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.377 -0.374 . . . . 63.15 111.816 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 41.4 mtp85 -64.36 -28.88 70.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.189 0.44 . . . . 73.45 112.189 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -55.32 -43.39 74.87 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.285 0.564 . . . . 73.43 110.491 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -97.84 -6.15 33.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.773 -0.649 . . . . 74.22 111.838 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 60.17 42.83 14.84 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.053 0.454 . . . . 42.34 111.922 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -87.57 -175.96 48.45 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.268 -0.491 . . . . 72.34 113.784 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.6 m -94.76 131.45 40.58 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.649 0.38 . . . . 74.31 111.315 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.34 125.56 70.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 112.165 0.431 . . . . 62.31 112.165 -178.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -136.26 144.83 45.01 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.217 -0.447 . . . . 72.12 110.773 173.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 44.3 p90 -142.84 140.68 31.38 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.566 0.58 . . . . 73.11 112.566 -176.295 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 p -115.24 141.83 47.49 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 116.01 -0.541 . . . . 71.34 111.696 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -113.36 125.73 54.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.031 0.443 . . . . 74.43 112.067 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.47 96.35 2.97 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.29 -0.414 . . . . 73.21 110.346 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.89 -101.12 0.62 Allowed Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.993 -0.622 . . . . 61.22 112.862 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -110.04 3.93 20.81 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.973 0.416 . . . . 70.43 110.992 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -93.8 130.74 39.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.097 -0.502 . . . . 73.11 112.044 -175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.1 tp -131.68 101.55 5.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.097 -0.502 . . . . 74.41 110.955 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.5 tt0 -97.27 108.77 21.57 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.884 0.374 . . . . 75.01 111.116 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.8 mt -101.95 108.57 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.226 -0.443 . . . . 65.42 110.867 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -93.11 111.3 22.89 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.878 0.371 . . . . 61.42 110.684 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.7 mt -101.98 110.41 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.312 0.577 . . . . 65.24 110.734 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -97.84 130.44 44.75 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 72.24 111.154 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.05 -15.88 15.82 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 120.95 -0.643 . . . . 52.32 113.558 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.928 HG23 HH22 ' A' ' 54' ' ' ARG . 15.1 m -61.2 138.64 94.5 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-N 117.221 0.511 . . . . 73.11 112.086 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.62 -176.87 3.2 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.191 2.594 . . . . 61.24 114.286 -173.7 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 10.2 pt-20 -90.49 -50.48 5.92 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.581 0.585 . . . . 64.3 112.581 -176.507 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -64.11 -40.5 96.33 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.649 0.611 . . . . 70.44 112.649 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.415 ' O ' HG12 ' A' ' 53' ' ' VAL . 22.8 t -73.58 -3.33 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 CA-C-O 120.955 0.407 . . . . 75.3 111.847 -177.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.928 HH22 HG23 ' A' ' 49' ' ' VAL . 18.4 tpp180 -51.22 -35.39 36.53 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.127 0.417 . . . . 72.32 112.127 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -55.76 -53.59 54.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.255 0.55 . . . . 75.42 111.378 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -74.54 -32.86 62.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.158 -0.474 . . . . 70.42 111.864 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.3 mt -56.75 -43.66 80.97 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.114 0.483 . . . . 53.33 111.065 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.07 73.29 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.026 0.441 . . . . 74.11 111.109 175.052 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -56.52 -39.61 73.64 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.961 -0.563 . . . . 75.33 111.94 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -64.81 -48.22 75.19 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.908 0.385 . . . . 44.32 110.904 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.28 -43.9 88.21 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.155 -0.475 . . . . 61.25 111.264 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 49.5 mt-10 -60.96 -42.14 97.72 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.309 -0.405 . . . . 71.44 111.168 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 27.9 ttm180 -55.26 -54.9 37.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.69 0.281 . . . . 75.44 110.653 174.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.5 mt -52.63 -45.9 66.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.17 -0.468 . . . . 71.42 111.675 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.67 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.402 -0.363 . . . . 72.5 111.85 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 34.0 mmtp -72.3 -30.23 64.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.178 0.436 . . . . 65.15 112.178 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.7 mm-40 -61.9 -38.51 88.62 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 122.118 -0.364 . . . . 73.43 111.598 178.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -100.87 -5.89 25.48 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.862 0.319 . . . . 62.53 111.862 178.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.2 t30 56.64 60.03 3.28 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.643 0.735 . . . . 75.4 110.551 -173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 39.6 pt -125.39 -176.37 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 115.502 -0.772 . . . . 71.41 111.28 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.5 m -98.89 141.42 31.69 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.596 -0.275 . . . . 44.11 111.712 -177.545 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.1 p -142.03 129.26 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.449 0.642 . . . . 74.41 111.792 176.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -129.87 123.29 30.47 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 116.12 -0.491 . . . . 43.23 110.273 175.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.7 p90 -125.57 136.63 53.5 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.523 0.677 . . . . 74.44 112.734 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 64.9 m -103.56 123.16 46.43 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.512 -0.767 . . . . 62.32 110.936 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.669 HD12 ' HD2' ' A' ' 54' ' ' ARG . 42.4 mm -94.22 114.13 30.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.68 0.276 . . . . 75.23 111.67 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 120.952 0.406 . . . . 74.1 111.317 177.387 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' N ' ' A' ' 2' ' ' GLU . 6.3 tmm? . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 110.062 -0.347 . . . . 55.11 110.062 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.528 ' N ' ' SD ' ' A' ' 1' ' ' MET . 26.5 mt-10 -132.62 137.71 47.13 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.072 0.463 . . . . 72.43 111.788 -175.556 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.539 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.3 ttt -139.33 106.91 5.58 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.943 -0.571 . . . . 72.42 111.247 -170.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.482 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 16.0 m-20 -90.89 106.93 18.86 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.476 0.311 . . . . 62.45 111.39 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.9 mm -97.51 109.3 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.706 0.289 . . . . 75.34 111.208 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 2.5 ttp180 -118.67 116.35 26.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.325 0.583 . . . . 72.11 112.097 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -95.15 142.57 27.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.839 -0.618 . . . . 74.51 111.379 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -141.91 121.11 13.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.144 -0.48 . . . . 73.34 111.222 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.61 -165.22 36.47 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.964 -0.636 . . . . 35.22 113.311 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -123.66 102.13 7.67 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 122.48 -0.424 . . . . 60.23 111.867 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -176.82 141.86 0.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.051 -0.522 . . . . 75.34 110.416 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.1 tp -76.01 -44.48 39.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 111.97 0.359 . . . . 74.45 111.97 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 4.8 mp0 -73.97 -27.52 61.03 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 112.1 0.407 . . . . 53.43 112.1 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -47.59 68.12 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.193 0.812 . . . . 31.12 113.193 -173.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -60.95 -61.27 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.22 0.452 . . . . 65.44 112.22 -176.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.46 -39.38 91.93 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.597 0.591 . . . . 73.4 112.597 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 10.5 mmmt -65.83 -52.93 46.41 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.27 0.47 . . . . 62.31 112.27 -179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.8 88.19 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.294 0.568 . . . . 61.52 110.791 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 tp -63.26 -41.44 99.05 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.682 -0.69 . . . . 53.53 111.43 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -57.22 -48.46 78.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.157 -0.474 . . . . 65.53 111.935 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -60.61 -44.87 95.81 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.09 0.472 . . . . 74.32 111.384 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 96.3 mmm -61.53 -49.08 78.15 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.192 -0.458 . . . . 72.42 111.525 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.82 -37.68 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 120.741 0.305 . . . . 73.35 111.366 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -53.67 -47.9 69.96 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.892 0.377 . . . . 75.54 111.119 177.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.642 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 72.2 mm-40 -74.35 -40.16 62.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.322 -0.399 . . . . 64.24 111.276 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.13 -38.58 79.97 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.308 0.484 . . . . 50.33 112.308 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -59.92 -29.55 68.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.061 0.458 . . . . 72.35 111.466 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.642 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 50.7 mtpt -72.22 -13.81 61.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.162 -0.472 . . . . 73.33 111.759 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -110.46 -177.26 3.19 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.013 0.435 . . . . 70.32 111.167 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -96.93 -10.72 25.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.765 0.317 . . . . 54.43 111.746 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.34 150.61 51.95 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.488 -0.387 . . . . 74.11 113.76 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 144.52 27.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.028 0.442 . . . . 63.14 111.518 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.444 HG22 HG23 ' A' ' 46' ' ' ILE . 84.5 t -129.36 131.61 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.161 -0.472 . . . . 53.53 111.045 178.15 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -131.8 140.25 49.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.733 0.302 . . . . 45.1 110.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -131.8 151.48 51.64 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.291 0.478 . . . . 74.2 112.291 -174.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 t -137.26 131.68 32.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.062 -0.517 . . . . 65.55 111.33 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mm? -100.91 123.61 45.36 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.947 0.403 . . . . 75.34 111.271 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -121.7 83.86 2.16 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.26 0.552 . . . . 71.32 110.209 174.538 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.23 -101.2 0.3 Allowed Glycine 0 CA--C 1.528 0.857 0 CA-C-N 115.752 -0.658 . . . . 62.41 113.159 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -108.58 21.77 16.84 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.059 0.457 . . . . 55.11 111.437 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -127.94 140.5 51.96 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 116.087 -0.506 . . . . 73.11 110.377 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 31.7 tp -134.17 118.81 18.07 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.104 0.409 . . . . 74.33 112.104 -177.24 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -108.83 131.77 54.66 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.641 0.257 . . . . 72.2 110.743 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -127.11 109.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 120.88 0.372 . . . . 71.5 110.981 -179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 45' ' ' ARG . 15.2 ttp85 -92.48 108.54 20.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.002 0.429 . . . . 73.21 111.402 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.444 HG23 HG22 ' A' ' 33' ' ' VAL . 58.2 mt -102.74 136.63 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 116.11 -0.496 . . . . 52.45 111.369 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.8 m -144.04 121.77 11.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 122.24 -0.288 . . . . 63.14 111.386 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 133.04 -27.8 3.41 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 120.87 -0.681 . . . . 62.45 114.275 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.3 m -71.24 134.64 84.91 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 122.238 -0.566 . . . . 72.24 111.7 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.97 153.91 74.08 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.719 2.279 . . . . 64.21 113.512 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -56.73 -31.24 64.34 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.555 0.946 . . . . 62.41 113.555 -175.527 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -71.83 -33.88 68.84 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.411 0.523 . . . . 72.01 112.411 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -81.41 -30.12 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 121.186 0.517 . . . . 73.11 110.677 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.476 ' HE ' ' HB3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -49.09 -45.75 43.69 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.591 -0.731 . . . . 73.34 112.194 177.357 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -65.18 -31.03 72.0 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.865 0.364 . . . . 64.23 111.712 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -71.51 -44.67 64.24 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.091 0.472 . . . . 74.35 110.233 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.34 -35.78 81.52 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.045 -0.525 . . . . 72.45 111.15 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.38 -45.05 95.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.996 0.427 . . . . 74.02 111.247 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.2 -43.71 87.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.85 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.65 -42.23 86.97 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.132 -0.486 . . . . 74.5 111.191 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.79 -45.42 78.22 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.993 0.425 . . . . 71.2 111.418 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -64.99 -36.47 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.987 0.422 . . . . 72.24 111.034 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.421 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 9.9 tpp180 -59.49 -48.04 83.18 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.249 -0.432 . . . . 63.51 110.26 175.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.29 -43.6 74.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.695 -0.684 . . . . 75.02 111.627 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.56 75.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.185 0.517 . . . . 64.22 111.278 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.32 -38.01 86.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.966 -0.561 . . . . 72.45 111.409 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 8.1 mm-40 -53.27 -35.4 60.01 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.409 -0.36 . . . . 63.31 111.834 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -114.74 6.19 15.51 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.315 0.487 . . . . 73.33 112.315 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 60.83 24.97 14.89 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.844 0.354 . . . . 74.15 111.834 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -101.49 -179.51 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.902 0.382 . . . . 63.31 111.506 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 95.6 m -102.67 131.75 49.25 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.8 0.333 . . . . 74.41 111.778 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -111.09 134.2 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.261 0.553 . . . . 74.54 111.228 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.9 p -130.84 121.1 24.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.951 -0.568 . . . . 73.24 110.224 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 17.0 p90 -129.5 129.35 44.44 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.366 0.603 . . . . 64.44 112.51 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.9 m -103.73 119.17 38.36 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.561 -0.745 . . . . 64.41 110.518 178.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.539 HG12 ' HG3' ' A' ' 3' ' ' MET . 24.2 mt -122.95 133.83 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 122.063 -0.398 . . . . 73.42 112.029 -175.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.4 HH21 ' CD ' ' A' ' 2' ' ' GLU . 35.0 ptt180 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 121.122 0.487 . . . . 70.35 111.155 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.793 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 35.5 ttm . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.705 0.288 . . . . 75.42 111.022 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 77' ' ' ARG . 37.6 tt0 -127.2 132.63 50.42 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.683 0.278 . . . . 65.42 110.631 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.547 ' HG3' HG12 ' A' ' 76' ' ' ILE . 25.9 ttt -130.14 118.09 20.94 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 120.826 0.346 . . . . 73.22 111.576 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 13.4 t70 -97.49 114.66 26.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.832 0.453 . . . . 51.3 110.796 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 62.2 mt -121.84 113.54 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 122.372 0.269 . . . . 65.54 111.462 -177.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.543 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 6.0 ptm180 -106.93 138.06 43.82 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.136 0.493 . . . . 73.31 112.16 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.93 142.19 44.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.031 -0.531 . . . . 71.13 110.996 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.525 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 26.4 ttt85 -142.46 132.43 24.41 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.591 -0.277 . . . . 74.34 110.722 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.46 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -179.37 -165.48 33.61 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 120.441 -0.885 . . . . 75.31 113.949 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.23 -19.91 12.07 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 122.697 0.399 . . . . 74.12 111.885 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.3 118.2 8.31 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.18 0.514 . . . . 75.22 112.353 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.06 -61.01 2.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.978 -0.555 . . . . 55.15 112.352 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.573 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 43.5 tt0 -60.48 -26.64 66.96 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.057 0.391 . . . . 70.05 112.057 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.41 -28.79 31.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.676 0.274 . . . . 44.03 111.351 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.68 -60.36 3.67 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.336 -0.393 . . . . 65.05 111.337 174.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -71.01 -28.57 64.5 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.514 -0.312 . . . . 64.23 111.649 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HG2' ' HG2' ' A' ' 13' ' ' GLU . 31.8 mmmt -67.76 -54.91 15.46 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.863 0.363 . . . . 74.23 111.082 177.926 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -64.84 -51.59 61.24 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.261 -0.427 . . . . 73.15 111.437 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.97 -48.35 70.42 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.901 0.381 . . . . 74.51 111.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -60.85 -45.98 92.37 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.351 -0.386 . . . . 63.55 111.816 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 25' ' ' GLN . 17.3 mm-40 -64.15 -44.92 90.63 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.871 0.322 . . . . 72.34 111.871 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 96.6 mmm -56.56 -53.09 61.56 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.997 0.427 . . . . 63.35 111.335 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.558 ' HA ' HG21 ' A' ' 33' ' ' VAL . 60.9 mt -61.39 -41.07 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.243 0.544 . . . . 62.32 110.809 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.46 -36.6 64.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.594 -0.73 . . . . 64.33 111.995 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 21' ' ' GLU . 29.7 mm-40 -74.26 -54.18 8.24 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.997 0.427 . . . . 75.13 111.663 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.2 75.44 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.737 1.014 . . . . 73.14 113.737 -171.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -56.95 -27.81 61.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.232 0.827 . . . . 73.2 113.232 -174.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.06 -25.91 66.49 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.724 0.297 . . . . 52.33 111.688 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -107.88 -175.37 2.76 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.021 0.439 . . . . 70.22 111.802 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.38 33.5 0.35 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.005 0.431 . . . . 72.05 111.941 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.73 161.83 12.89 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.264 -0.493 . . . . 73.41 113.819 -175.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.7 m -132.22 135.96 46.67 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.463 0.305 . . . . 60.2 110.71 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 23' ' ' ILE . 95.0 t -98.25 113.86 34.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.044 0.45 . . . . 72.32 112.15 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 t -107.91 141.51 39.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.209 -0.45 . . . . 61.03 110.225 173.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 40.1 p90 -150.53 152.01 33.52 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.984 0.421 . . . . 74.23 112.094 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.3 t -132.36 138.58 47.79 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.078 -0.51 . . . . 75.54 111.5 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.18 140.35 37.47 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.918 0.389 . . . . 73.43 112.037 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.32 99.97 2.4 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.208 -0.451 . . . . 74.14 110.93 171.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.94 -95.13 0.06 OUTLIER Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.272 -0.49 . . . . 51.55 113.392 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -111.31 4.65 19.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.062 0.393 . . . . 74.23 112.062 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -108.47 137.68 46.03 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.321 0.582 . . . . 54.15 112.477 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 tp -134.3 99.46 4.39 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.36 -0.836 . . . . 73.33 110.452 176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 31.7 mt-10 -93.0 115.97 28.62 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.162 -0.337 . . . . 71.11 111.217 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 74.1 mt -114.11 109.93 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 116.243 -0.435 . . . . 75.44 111.907 -176.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -106.53 132.13 52.89 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.002 -0.436 . . . . 73.24 111.354 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.535 HG12 HG22 ' A' ' 33' ' ' VAL . 45.8 mt -107.63 114.35 46.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.082 0.468 . . . . 74.14 110.805 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.7 m -101.61 122.35 43.7 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.272 -0.422 . . . . 74.22 111.846 -178.29 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.85 49.6 1.15 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.251 -0.5 . . . . 61.34 114.335 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.3 m -122.81 144.91 43.96 Favored Pre-proline 0 N--CA 1.472 0.65 0 O-C-N 122.233 -0.569 . . . . 71.52 112.269 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.39 160.06 39.28 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.03 2.487 . . . . 74.23 112.109 172.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -62.39 -36.94 83.89 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.994 -0.441 . . . . 72.41 111.955 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -61.11 -19.99 62.12 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.122 0.487 . . . . 75.31 111.183 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.75 -36.5 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 116.063 -0.517 . . . . 62.21 110.889 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.793 ' HD2' ' SD ' ' A' ' 1' ' ' MET . 31.4 ttt180 -45.55 -53.08 9.52 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.242 0.544 . . . . 71.43 111.528 173.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -58.77 -34.12 71.07 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.915 -0.584 . . . . 74.04 111.674 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -75.54 -35.26 60.72 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.285 -0.416 . . . . 71.23 111.428 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.84 -45.04 94.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.076 0.465 . . . . 74.51 110.849 176.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 62' ' ' GLU . . . -60.76 -50.42 73.55 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.149 -0.478 . . . . 71.04 111.159 175.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -55.17 -36.8 66.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.156 -0.475 . . . . 70.14 112.21 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -75.12 -43.89 50.2 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.975 0.417 . . . . 71.01 111.112 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.06 -38.05 78.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.755 0.312 . . . . 61.23 111.78 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 7.1 mm-40 -53.38 -46.34 69.61 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.971 0.415 . . . . 74.3 111.047 175.928 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ttm-85 -61.67 -50.93 70.52 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.965 0.412 . . . . 75.35 110.694 178.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.83 -43.88 66.32 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.908 -0.587 . . . . 73.22 111.778 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.468 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -66.18 -57.32 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.012 0.434 . . . . 52.34 111.981 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -62.67 -43.07 99.75 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.43 0.53 . . . . 75.21 112.43 -175.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.43 -36.86 83.71 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.953 0.406 . . . . 75.53 111.804 -174.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.33 7.69 31.38 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.844 0.313 . . . . 65.13 111.844 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 58.38 27.69 15.74 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.028 0.442 . . . . 65.11 112.01 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 65' ' ' ALA . 24.5 pt -96.25 154.84 3.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 121.056 0.455 . . . . 72.23 111.062 178.402 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.525 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 45.8 p -88.31 143.14 27.2 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.959 0.409 . . . . 52.21 111.88 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 12.1 p -141.88 135.6 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.18 0.514 . . . . 75.25 112.172 -177.356 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.7 p -128.75 143.22 50.87 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.371 -0.377 . . . . 72.34 110.014 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 21.0 p90 -131.35 115.33 16.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.394 0.616 . . . . 73.24 112.279 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 96.6 m -104.19 124.93 50.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.729 -0.669 . . . . 74.22 110.418 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.547 HG12 ' HG3' ' A' ' 3' ' ' MET . 44.3 mt -118.64 139.81 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.131 0.491 . . . . 73.53 112.237 -174.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 2' ' ' GLU . 18.8 ptt180 . . . . . 0 CA--C 1.539 0.546 0 CA-C-N 116.117 -0.492 . . . . 62.42 110.636 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.7 ' SD ' ' HD3' ' A' ' 54' ' ' ARG . 47.5 ttp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.715 0.293 . . . . 75.54 111.144 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLU . . . . . 0.529 ' CD ' HH21 ' A' ' 45' ' ' ARG . 40.4 mt-10 -132.31 142.41 49.35 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.966 0.412 . . . . 75.52 111.36 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -133.06 118.63 18.99 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.289 0.566 . . . . 74.21 111.294 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -100.73 114.43 28.19 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.744 -0.662 . . . . 72.1 110.814 -178.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.1 mt -106.39 120.42 57.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.264 0.554 . . . . 74.41 111.365 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -103.7 105.32 15.51 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.067 -0.515 . . . . 72.14 111.747 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -93.56 146.98 23.4 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.156 0.503 . . . . 74.23 111.974 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -143.03 120.78 11.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.304 -0.407 . . . . 71.15 110.674 171.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.65 156.52 28.23 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.776 -0.726 . . . . 63.52 112.94 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -89.1 -30.15 18.86 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.807 0.336 . . . . 74.23 111.412 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.9 120.53 13.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.948 0.404 . . . . 62.44 111.793 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 48.1 tp -63.75 -41.27 98.04 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.993 0.425 . . . . 54.14 111.316 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.09 -36.8 71.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.088 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -40.56 83.53 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.332 -0.395 . . . . 75.41 111.423 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 12' ' ' LEU . 15.3 t80 -53.72 -58.68 6.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.193 -0.458 . . . . 72.34 111.74 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.69 -40.58 72.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.001 0.371 . . . . 72.22 112.001 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 67.9 mmtt -62.98 -46.7 86.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.393 0.516 . . . . 65.24 112.393 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.83 -49.05 79.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.902 0.382 . . . . 52.44 111.104 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -61.24 -41.02 96.17 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.128 0.489 . . . . 65.31 111.177 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -58.99 -54.86 42.42 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.768 -0.651 . . . . 74.33 111.802 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.99 -42.47 97.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.209 0.448 . . . . 72.01 112.209 -176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 85.3 mmm -57.66 -48.57 79.13 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.119 -0.363 . . . . 73.3 111.148 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 63.0 mt -66.47 -38.44 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.212 0.53 . . . . 74.51 110.863 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.633 -0.712 . . . . 63.44 111.624 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -73.89 -40.92 62.83 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.641 0.258 . . . . 73.44 111.58 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.13 -29.97 64.03 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.856 0.687 . . . . 74.42 112.856 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.5 mtp180 -56.77 -29.57 62.77 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.378 0.51 . . . . 74.24 112.378 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HB3' ' NZ ' ' A' ' 28' ' ' LYS . 3.5 mmmp? -75.26 -13.27 60.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.038 0.447 . . . . 72.24 111.715 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -120.54 178.73 4.56 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.07 0.462 . . . . 73.24 111.281 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.99 38.0 0.33 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.193 0.52 . . . . 72.24 111.505 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.35 124.64 7.68 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 114.345 0.498 . . . . 71.41 114.345 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -101.38 117.76 35.6 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.691 0.396 . . . . 65.45 109.997 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.416 HG22 HG12 ' A' ' 46' ' ' ILE . 49.0 t -108.13 130.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 120.956 0.408 . . . . 63.43 112.047 -176.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -132.74 161.2 34.65 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.296 -0.411 . . . . 74.32 110.972 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 28.4 p90 -151.36 152.76 33.57 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.575 0.583 . . . . 72.11 112.575 -175.001 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 t -137.15 134.69 36.64 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.815 -0.63 . . . . 74.42 111.045 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.427 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.2 mm? -99.36 139.96 34.24 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.246 0.546 . . . . 73.4 112.3 -178.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -142.89 86.0 1.91 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.971 -0.558 . . . . 75.3 110.529 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.56 -89.76 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 121.367 -0.444 . . . . 70.13 113.481 -178.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -95.44 -25.76 16.12 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.691 0.397 . . . . 62.24 111.781 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -93.16 147.22 23.07 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.539 0.685 . . . . 75.22 112.659 -171.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD21 HD11 ' A' ' 44' ' ' ILE . 43.3 tp -134.95 104.33 5.93 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.158 -0.928 . . . . 71.14 110.192 178.374 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.46 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.3 tt0 -94.35 111.08 22.8 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.701 0.286 . . . . 73.42 111.107 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.404 HD11 HD21 ' A' ' 42' ' ' LEU . 65.8 mt -112.78 109.85 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-N 116.435 -0.348 . . . . 70.12 111.341 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.529 HH21 ' CD ' ' A' ' 2' ' ' GLU . 61.8 ttt180 -104.64 120.01 40.33 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.981 0.419 . . . . 74.54 111.145 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.416 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -106.95 125.89 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.936 0.398 . . . . 75.33 111.299 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -121.34 136.59 54.94 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.346 -0.388 . . . . 34.43 111.762 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.19 -13.94 40.24 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.755 -0.736 . . . . 71.24 114.193 174.394 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.35 138.1 95.72 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 117.268 0.534 . . . . 75.35 111.837 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.475 ' HG2' HG23 ' A' ' 53' ' ' VAL . 42.7 Cg_endo -68.8 152.6 73.91 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.382 2.055 . . . . 72.14 113.361 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -45.24 -43.11 10.12 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.836 1.05 . . . . 75.31 113.836 -176.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.21 -37.66 87.99 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.642 0.608 . . . . 70.4 112.642 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.532 HG12 ' HG ' ' A' ' 57' ' ' LEU . 57.6 t -73.89 -23.51 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.025 0.441 . . . . 74.2 111.708 -177.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 42.8 ttp180 -46.68 -50.52 17.71 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.334 0.588 . . . . 74.04 111.708 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -59.27 -44.77 92.42 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.244 -0.889 . . . . 70.22 112.029 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -68.95 -48.42 63.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.038 -0.528 . . . . 64.52 111.67 -175.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.532 ' HG ' HG12 ' A' ' 53' ' ' VAL . 87.1 mt -59.66 -33.85 72.08 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.555 0.217 . . . . 72.32 111.524 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.194 0.521 . . . . 61.31 110.594 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 ttpp -57.45 -45.46 84.73 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.752 -0.658 . . . . 72.4 111.226 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.98 95.67 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.49 -0.323 . . . . 74.34 111.79 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.37 -42.55 87.26 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.102 0.477 . . . . 45.33 111.291 177.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.29 -42.4 93.17 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.222 -0.444 . . . . 74.24 111.336 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -64.92 -37.96 89.37 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.734 0.302 . . . . 52.11 111.139 177.332 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.8 mt -57.38 -43.22 83.41 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.947 0.404 . . . . 65.35 110.65 172.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.98 -51.52 69.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.072 -0.513 . . . . 74.35 111.776 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -67.79 -26.24 65.99 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.222 0.453 . . . . 72.03 112.222 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.94 -50.56 72.97 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.949 0.404 . . . . 64.41 111.63 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -108.54 7.27 26.69 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.17 0.433 . . . . 74.2 112.17 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.8 t30 58.57 66.61 1.05 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.321 0.581 . . . . 74.43 111.356 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.8 pt -130.46 172.23 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 116.17 -0.468 . . . . 70.13 111.23 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.7 m -96.34 135.68 37.85 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.585 -0.279 . . . . 74.23 111.324 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.29 138.76 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.171 0.51 . . . . 60.22 112.118 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.6 p -127.43 172.87 10.28 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.999 -0.546 . . . . 63.24 109.742 172.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -145.92 115.77 7.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.364 0.602 . . . . 70.11 112.451 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 97.4 m -93.18 104.54 16.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.689 -0.687 . . . . 64.32 110.139 173.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.498 HG21 ' HD2' ' A' ' 54' ' ' ARG . 52.8 mt -111.93 129.42 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.947 0.403 . . . . 65.43 111.811 -175.533 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 121.177 0.513 . . . . 65.34 111.086 179.369 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.944 0.402 . . . . 73.53 111.358 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -115.11 148.02 39.49 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.244 -0.435 . . . . 70.53 110.949 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' MET . . . . . 0.505 ' HG3' HG12 ' A' ' 76' ' ' ILE . 27.1 ttt -130.6 107.69 9.37 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.182 0.515 . . . . 71.14 111.663 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.511 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 2.9 m-20 -81.91 104.6 12.39 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.875 -0.602 . . . . 72.13 111.158 176.59 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.7 mt -107.74 109.41 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 120.99 0.424 . . . . 70.24 111.281 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.73 107.06 18.16 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.568 -0.287 . . . . 72.45 111.549 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.03 138.56 31.3 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.553 -0.294 . . . . 74.11 110.226 172.223 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -137.54 120.29 16.28 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.806 0.336 . . . . 64.32 110.615 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.4 149.53 16.08 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.053 -0.594 . . . . 55.34 112.938 -178.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.04 23.67 1.72 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 120.831 0.348 . . . . 63.31 111.648 -178.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -119.53 120.84 37.92 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 120.888 0.375 . . . . 72.42 111.393 -175.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 49.9 tp -72.23 -38.25 68.98 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.153 0.427 . . . . 64.32 112.153 -176.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.45 -40.4 93.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.88 0.372 . . . . 74.34 111.221 178.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.4 -43.32 83.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.164 -0.471 . . . . 72.23 111.156 175.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.553 ' HE1' HD13 ' A' ' 42' ' ' LEU . 56.6 t80 -50.03 -55.31 15.28 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.684 -0.689 . . . . 63.14 111.577 176.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.64 -56.28 19.22 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.975 0.361 . . . . 73.13 111.975 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -61.97 -49.29 76.7 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.674 0.62 . . . . 71.24 112.674 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.46 -48.38 82.03 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.974 0.416 . . . . 64.23 111.574 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.9 tp -62.76 -43.39 98.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.045 0.45 . . . . 74.25 111.473 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -57.95 -47.85 81.68 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.88 -0.6 . . . . 62.21 111.763 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -66.66 -33.15 75.01 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.372 0.508 . . . . 72.04 112.372 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.42 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.4 mmm -66.07 -47.61 73.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.976 0.417 . . . . 73.42 110.895 176.435 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.71 -39.55 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 116.282 -0.417 . . . . 72.24 111.033 177.526 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.0 ttm-85 -54.58 -45.45 73.56 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.138 0.494 . . . . 73.04 111.204 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -72.45 -45.92 57.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.235 -0.439 . . . . 53.44 111.548 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.82 -34.96 70.22 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.245 0.461 . . . . 71.41 112.245 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -58.44 -28.72 65.55 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.043 0.386 . . . . 75.41 112.043 177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -66.21 -33.66 76.26 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.13 0.491 . . . . 74.12 111.228 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -96.54 -178.03 4.13 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.216 -0.447 . . . . 72.13 111.425 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.18 4.12 43.71 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.21 0.448 . . . . 72.13 112.21 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.91 159.62 42.02 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.186 -0.53 . . . . 50.32 113.812 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.7 m -119.1 144.49 46.58 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 122.609 -0.348 . . . . 52.01 110.767 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.401 HG22 HG12 ' A' ' 46' ' ' ILE . 64.5 t -117.7 124.43 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 112.036 0.384 . . . . 71.42 112.036 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -118.31 148.69 42.22 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.441 -0.345 . . . . 63.43 110.483 172.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' LEU . 52.7 p90 -150.71 138.25 19.66 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.483 . . . . 73.43 112.138 -177.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.2 p -123.88 119.78 30.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.09 -0.504 . . . . 54.22 110.808 176.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.4 tp -93.73 101.47 13.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.119 0.485 . . . . 74.14 111.629 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -99.04 96.88 8.1 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.122 -0.49 . . . . 74.22 110.773 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.64 -90.33 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.3 -0.476 . . . . 64.14 113.154 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -119.6 -1.04 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.855 0.36 . . . . 73.5 111.11 179.354 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.15 121.81 44.59 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.273 -0.421 . . . . 75.4 111.396 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.553 HD13 ' HE1' ' A' ' 15' ' ' PHE . 64.6 tp -104.02 99.67 9.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.177 0.513 . . . . 73.42 110.659 176.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -85.28 104.52 15.2 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.215 -0.448 . . . . 72.34 111.197 179.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.5 mt -103.48 136.41 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.346 -0.388 . . . . 73.54 111.395 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -125.39 115.6 20.55 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.943 0.401 . . . . 71.05 110.771 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.401 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -101.64 115.3 43.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.036 0.446 . . . . 73.43 110.689 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.9 m -101.43 123.68 45.88 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.284 -0.416 . . . . 74.13 111.6 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.22 65.01 1.22 Allowed Glycine 0 CA--C 1.527 0.798 0 C-N-CA 121.091 -0.576 . . . . 73.11 113.46 176.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.6 m -113.85 133.87 22.2 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 122.551 -0.382 . . . . 71.11 111.923 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.453 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 37.5 Cg_endo -65.57 125.78 14.98 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.578 2.186 . . . . 73.32 112.837 178.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -54.7 -34.44 62.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.483 0.549 . . . . 75.43 112.483 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.528 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.7 pt20 -63.92 -40.02 95.5 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.737 0.303 . . . . 65.31 111.763 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.528 HG23 ' HG3' ' A' ' 52' ' ' GLN . 58.4 t -86.75 -19.07 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.816 0.341 . . . . 73.12 111.498 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HD2' HD13 ' A' ' 76' ' ' ILE . 16.4 ttp180 -48.81 -36.35 16.55 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.287 0.477 . . . . 63.14 112.287 -178.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -61.42 -40.97 96.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.879 0.371 . . . . 65.23 111.481 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -69.84 -35.94 75.15 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.798 0.333 . . . . 70.45 111.042 177.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.44 -43.2 91.15 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.057 0.456 . . . . 53.24 110.853 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.53 94.43 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.243 0.544 . . . . 75.33 110.865 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 27.9 ttpt -59.64 -50.74 72.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.025 -0.534 . . . . 63.03 111.189 174.527 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -69.64 -37.8 76.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.94 -0.573 . . . . 63.43 111.713 -174.122 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.17 -51.82 55.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.042 0.449 . . . . 60.32 111.493 178.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 42.2 mt-10 -72.92 -31.49 64.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.484 -0.326 . . . . 63.24 111.357 176.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -57.3 -48.67 78.33 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.882 0.372 . . . . 72.31 110.306 178.419 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.9 mt -52.79 -47.3 67.68 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.991 -0.549 . . . . 63.33 111.188 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.81 -42.06 83.46 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.051 -0.522 . . . . 75.54 111.874 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 62.1 mttm -68.64 -26.61 65.42 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.404 -0.362 . . . . 73.14 111.664 -178.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -68.55 -48.99 62.84 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.198 0.523 . . . . 72.33 111.198 174.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -96.14 1.33 52.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.487 0.551 . . . . 62.42 112.487 -175.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 61.72 26.17 15.88 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.084 0.401 . . . . 71.33 112.084 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -103.65 175.58 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 121.215 0.531 . . . . 63.32 112.425 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.8 m -97.3 139.73 32.83 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 116.181 -0.463 . . . . 72.14 112.042 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -146.37 137.28 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.978 0.418 . . . . 73.11 111.663 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.4 p -128.66 139.11 52.41 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 116.664 -0.244 . . . . 53.45 110.594 175.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 43.5 p90 -127.27 119.38 26.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.363 0.601 . . . . 74.44 112.476 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . 0.443 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 71.7 m -103.55 139.81 38.37 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.733 -0.667 . . . . 74.33 109.714 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.505 HG12 ' HG3' ' A' ' 3' ' ' MET . 56.3 mt -131.15 128.49 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 121.864 -0.522 . . . . 75.14 112.408 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 109.884 -0.413 . . . . 75.44 109.884 173.945 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.516 ' HE1' ' HA ' ' A' ' 51' ' ' GLU . 55.4 ttp . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 120.994 0.426 . . . . 72.15 111.532 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.07 146.3 51.06 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.573 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.0 ptm -131.65 121.95 25.15 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.9 0.704 . . . . 61.35 112.9 -175.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.55 ' HB3' ' NH1' ' A' ' 6' ' ' ARG . 3.8 m-20 -86.01 134.9 33.83 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.868 -0.605 . . . . 74.21 111.545 173.476 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.3 mt -139.24 133.24 39.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.101 0.56 . . . . 73.33 110.055 173.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.55 ' NH1' ' HB3' ' A' ' 4' ' ' ASP . 49.9 mtt85 -132.84 113.23 12.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.974 0.416 . . . . 72.32 112.02 -175.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.516 ' HE1' ' SD ' ' A' ' 22' ' ' MET . 97.0 m-85 -93.25 142.55 27.19 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.305 -0.407 . . . . 61.44 110.9 177.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.1 ttt180 -142.37 127.13 18.12 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.536 0.208 . . . . 70.24 111.514 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.558 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -170.27 -175.37 39.07 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 120.842 -0.694 . . . . 61.33 113.948 -178.348 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -95.2 -50.88 4.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.986 0.365 . . . . 74.11 111.986 -176.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -61.36 114.48 3.22 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.9 0.381 . . . . 73.11 111.049 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.55 -50.42 73.86 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.645 0.609 . . . . 64.21 112.645 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 22.0 mt-10 -56.23 -25.42 47.43 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.855 0.687 . . . . 72.54 112.855 -178.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.08 -34.02 59.08 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.754 0.311 . . . . 74.32 111.608 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.498 ' HB3' HD22 ' A' ' 42' ' ' LEU . 78.6 m-85 -72.05 -60.2 2.35 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.505 -0.316 . . . . 65.23 111.476 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 10.9 pt-20 -57.67 -40.67 79.9 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.122 0.416 . . . . 73.34 112.122 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -70.21 -42.45 72.32 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.1 0.407 . . . . 73.55 112.1 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -46.72 82.48 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.211 0.529 . . . . 64.43 110.415 174.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.427 ' HB2' HD21 ' A' ' 42' ' ' LEU . 64.3 tp -56.05 -43.57 78.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.69 -0.686 . . . . 72.1 111.247 175.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -56.14 -46.11 79.36 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.062 -0.517 . . . . 74.41 111.498 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -65.99 -40.26 91.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.714 0.292 . . . . 65.34 111.677 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' MET . . . . . 0.516 ' SD ' ' HE1' ' A' ' 7' ' ' PHE . 80.8 mtp -61.37 -53.29 58.52 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.72 0.295 . . . . 74.02 111.202 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.613 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 69.1 mt -59.49 -42.31 87.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-O 120.931 0.396 . . . . 74.01 110.506 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -48.41 -50.34 31.4 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.948 -0.569 . . . . 65.31 111.562 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -75.14 -33.02 61.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.913 0.387 . . . . 62.03 111.663 178.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -31.9 73.27 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.384 0.512 . . . . 61.35 112.384 -178.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 43.3 mtp180 -63.91 -27.84 69.42 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.93 0.395 . . . . 73.52 111.333 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -57.13 -25.03 58.17 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.136 -0.484 . . . . 74.12 111.486 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -120.16 167.74 11.92 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.988 0.423 . . . . 75.34 110.999 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.13 87.27 7.15 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.469 . . . . 54.11 110.748 176.6 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -146.42 157.68 27.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.836 -0.697 . . . . 72.03 113.474 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.9 m -106.98 128.81 54.68 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 122.793 -0.24 . . . . 72.52 111.276 -179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -110.6 109.38 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 120.77 0.319 . . . . 73.23 111.33 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.6 p -101.06 130.46 47.09 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.392 0.277 . . . . 61.34 110.286 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 47.5 p90 -144.01 150.2 37.88 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.66 0.615 . . . . 71.55 112.66 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -139.28 133.59 31.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.993 -0.548 . . . . 71.35 111.398 171.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.8 tp -95.28 106.33 18.35 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.018 0.437 . . . . 71.01 110.483 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -126.82 118.23 24.22 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.023 0.44 . . . . 52.43 111.411 -172.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.04 -101.4 0.6 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.338 -0.458 . . . . 74.4 113.049 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -122.1 6.1 9.77 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 71.43 111.089 176.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.82 139.51 49.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.357 0.598 . . . . 71.33 112.067 -176.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.498 HD22 ' HB3' ' A' ' 15' ' ' PHE . 64.7 tp -108.02 101.72 10.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.102 -0.499 . . . . 72.01 109.84 172.065 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.519 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 7.9 tm-20 -81.52 115.04 20.64 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.925 -0.58 . . . . 74.51 110.556 -177.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -123.86 129.44 74.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 120.788 0.327 . . . . 74.21 111.616 -177.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -126.43 127.5 45.52 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 122.129 -0.357 . . . . 74.34 111.024 174.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.3 mt -111.89 124.22 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-O 120.976 0.417 . . . . 42.23 111.122 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -105.63 130.72 53.6 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.178 -0.465 . . . . 65.45 111.953 -177.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.67 28.47 8.89 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.197 -0.525 . . . . 61.55 113.832 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.484 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 13.7 m -89.63 134.72 31.81 Favored Pre-proline 0 CA--C 1.543 0.703 0 O-C-N 122.41 -0.465 . . . . 71.32 111.974 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 8.1 Cg_exo -74.9 144.77 31.04 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.862 2.375 . . . . 60.13 113.023 177.179 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 3.1 tm-20 -53.2 -48.43 68.11 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 120.98 0.419 . . . . 72.34 111.28 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.427 ' HG3' HG23 ' A' ' 53' ' ' VAL . 20.6 pt20 -56.13 -28.63 58.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.367 0.506 . . . . 74.12 112.367 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.427 HG23 ' HG3' ' A' ' 52' ' ' GLN . 46.4 t -94.92 -22.87 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.965 0.412 . . . . 74.33 111.262 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.435 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 23.2 ttp180 -50.84 -49.4 58.94 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.142 0.496 . . . . 73.14 111.598 179.575 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -54.77 -40.84 69.79 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.573 -0.74 . . . . 63.31 111.968 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.5 -44.87 66.75 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.414 -0.357 . . . . 74.21 111.437 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.409 ' HG ' HG12 ' A' ' 53' ' ' VAL . 94.4 mt -63.98 -42.96 97.06 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.773 0.32 . . . . 64.52 111.77 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.95 -50.04 72.36 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.894 0.378 . . . . 51.11 111.136 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 2.7 tmmm? -56.72 -47.55 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.135 -0.484 . . . . 74.51 110.531 175.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.49 -40.63 87.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.155 -0.475 . . . . 72.13 110.96 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.41 -46.26 86.79 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.929 0.395 . . . . 71.33 111.488 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.67 -41.61 95.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.069 0.461 . . . . 62.44 111.049 176.553 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.66 -42.03 98.14 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.356 -0.384 . . . . 70.24 111.289 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.25 -48.31 79.19 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.997 0.427 . . . . 63.12 111.179 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.413 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -53.53 -55.63 23.89 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.011 -0.54 . . . . 71.34 111.321 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -60.25 -35.47 75.55 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.228 -0.442 . . . . 72.1 111.975 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.96 -46.53 88.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.138 0.494 . . . . 74.13 111.397 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.18 7.58 43.68 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.488 -0.324 . . . . 65.51 111.783 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t30 58.82 32.93 22.71 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.583 0.706 . . . . 62.32 111.058 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.558 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.3 pt -111.78 164.09 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 116.178 -0.464 . . . . 42.2 111.512 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 53.9 m -94.98 134.67 37.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.382 -0.372 . . . . 64.24 111.039 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 12.7 p -122.96 135.8 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 121.27 0.557 . . . . 74.32 112.202 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.6 p -128.84 141.34 51.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.053 -0.521 . . . . 73.44 110.008 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -139.72 160.87 38.9 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.608 0.596 . . . . 62.42 112.608 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.1 m -149.93 109.67 4.06 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.785 -0.643 . . . . 75.35 110.154 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -106.09 127.95 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 112.148 0.425 . . . . 74.15 112.148 -174.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 1' ' ' MET . 45.9 mtt180 . . . . . 0 N--CA 1.47 0.545 0 CA-C-N 116.284 -0.416 . . . . 72.43 111.125 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.4 ' HE3' HG23 ' A' ' 49' ' ' VAL . 59.0 ttp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.809 0.338 . . . . 75.25 110.761 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.428 ' HG3' ' HA ' ' A' ' 47' ' ' THR . 4.5 mp0 -104.75 165.9 10.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.349 -0.387 . . . . 72.25 110.721 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.401 ' HG3' HD13 ' A' ' 76' ' ' ILE . 27.4 ttt -143.83 117.34 9.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.108 -0.37 . . . . 70.22 111.804 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 20.9 m-20 -94.62 103.85 15.79 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.812 0.339 . . . . 71.44 111.188 176.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.43 108.89 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.893 0.377 . . . . 71.23 110.563 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 58.0 mtp180 -99.94 107.21 19.12 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.604 -0.271 . . . . 64.52 111.497 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -90.35 126.58 35.92 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.796 0.331 . . . . 65.35 111.161 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 73.8 ttt-85 -127.06 120.12 28.22 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 110.067 -0.346 . . . . 74.55 110.067 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -142.57 -170.73 12.89 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 120.653 -0.784 . . . . 74.42 113.853 -172.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -103.9 -47.06 4.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.561 0.578 . . . . 72.41 112.561 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -100.83 152.79 20.1 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.961 -0.462 . . . . 73.43 111.688 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.97 -36.66 85.11 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.175 0.435 . . . . 72.44 112.175 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -58.53 -32.82 69.21 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.384 -0.371 . . . . 74.12 111.248 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.37 -45.48 80.5 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.063 0.459 . . . . 75.12 111.143 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -67.5 -47.05 71.12 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.142 0.496 . . . . 75.13 110.792 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -54.41 -57.94 9.37 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.723 -0.671 . . . . 71.42 112.14 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -65.33 -47.82 75.18 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.272 -0.422 . . . . 75.31 111.6 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.7 -51.2 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.403 . . . . 73.14 111.582 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.23 -45.06 88.39 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.139 0.495 . . . . 72.12 111.447 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -67.31 -31.73 72.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.141 -0.481 . . . . 63.32 111.752 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 27.0 mm-40 -70.18 -39.16 75.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.762 0.315 . . . . 73.31 111.444 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 90.5 mmm -59.93 -52.45 65.38 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.543 -0.299 . . . . 75.54 110.532 174.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.481 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 72.5 mt -58.02 -40.45 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.139 0.495 . . . . 70.14 111.209 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 68.9 ttt180 -48.52 -58.73 4.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.689 -0.687 . . . . 73.54 111.824 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -75.73 -39.22 57.63 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.41 0.522 . . . . 73.54 112.41 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.2 -30.03 59.11 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.563 0.579 . . . . 74.41 112.563 -175.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 74.9 mtp180 -59.87 -28.99 68.01 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.081 0.4 . . . . 71.13 112.081 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 12.7 mptt -74.16 -14.9 61.02 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.678 0.275 . . . . 71.1 111.56 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -110.79 149.47 30.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.84 0.352 . . . . 72.12 111.016 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.08 58.17 1.94 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.281 0.562 . . . . 61.3 111.559 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -131.0 133.15 7.13 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 116.107 -0.497 . . . . 75.55 112.276 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.4 m -85.97 117.83 25.06 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.857 0.361 . . . . 63.51 111.627 -176.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -92.31 109.59 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.229 0.538 . . . . 64.45 111.927 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.4 p -113.41 153.58 28.37 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.208 -0.451 . . . . 73.13 110.153 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -156.43 149.05 23.69 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.667 0.617 . . . . 73.4 112.667 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.1 p -130.29 126.57 37.57 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.637 -0.71 . . . . 70.21 110.811 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.1 tp -97.87 99.42 10.74 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.048 0.452 . . . . 72.31 110.926 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -106.18 106.66 17.28 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.967 0.413 . . . . 72.04 110.838 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 60.7 -112.92 5.03 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.12 -0.562 . . . . 63.33 112.335 -175.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 47.3 t-20 -115.67 72.3 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.03 0.443 . . . . 72.22 110.175 173.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -175.99 122.28 0.18 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.576 -0.738 . . . . 63.45 109.785 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.2 tp -104.74 101.14 10.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 72.01 111.047 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -85.09 104.45 15.01 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.472 -0.331 . . . . 75.2 111.095 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.9 mt -99.6 109.07 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 111.773 0.286 . . . . 74.41 111.773 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -98.87 106.23 18.47 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.185 0.517 . . . . 62.02 111.578 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.9 mt -91.8 112.01 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.298 174.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.428 ' HA ' ' HG3' ' A' ' 2' ' ' GLU . 91.7 m -93.04 120.44 33.34 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.218 -0.446 . . . . 44.01 112.0 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.87 65.13 1.09 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.434 -0.412 . . . . 72.41 113.922 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.4 HG23 ' HE3' ' A' ' 1' ' ' MET . 16.4 m -122.06 136.56 26.4 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 122.405 -0.468 . . . . 74.54 111.914 177.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -78.65 150.8 24.72 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.598 2.199 . . . . 73.14 112.461 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -60.06 -30.63 69.34 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.852 0.686 . . . . 64.23 112.852 -174.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG3' HG23 ' A' ' 53' ' ' VAL . 28.9 pt20 -63.58 -45.62 89.59 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.948 0.404 . . . . 74.42 111.308 177.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.462 HG23 ' HG3' ' A' ' 52' ' ' GLN . 61.3 t -77.08 -27.72 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.869 0.366 . . . . 63.54 111.109 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.2 ttp180 -48.94 -40.98 32.38 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.161 0.505 . . . . 71.43 111.193 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -60.91 -51.84 67.58 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.822 -0.626 . . . . 71.42 111.311 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -62.09 -44.65 96.19 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.828 -0.624 . . . . 75.33 112.097 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.31 -45.68 75.79 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.771 0.319 . . . . 71.41 111.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.91 94.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.059 0.457 . . . . 73.44 111.508 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -72.27 -34.89 68.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.156 -0.475 . . . . 65.23 112.064 -178.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -71.39 -31.99 67.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.262 -0.575 . . . . 65.21 110.566 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.09 -44.09 78.67 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.951 0.405 . . . . 72.3 110.498 171.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -58.1 -50.0 74.99 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.335 0.588 . . . . 52.35 110.43 172.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 63' ' ' ARG . 13.5 tpt180 -53.41 -48.77 68.4 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.347 -0.842 . . . . 72.33 111.475 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.73 -50.69 72.39 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.182 0.515 . . . . 44.04 111.046 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.39 65.69 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.09 -0.504 . . . . 44.44 111.868 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -74.38 -59.8 2.56 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 122.372 -0.205 . . . . 74.04 111.463 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -35.45 70.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.304 0.483 . . . . 72.31 112.304 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -92.79 -6.87 48.0 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.185 -0.322 . . . . 74.25 111.8 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.1 t30 57.93 15.83 3.34 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.395 0.617 . . . . 71.55 111.828 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.1 pt -87.1 174.88 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.051 0.453 . . . . 65.15 111.84 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.1 m -90.01 139.06 30.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.196 -0.456 . . . . 75.41 111.317 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.2 p -135.67 126.6 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.183 0.516 . . . . 73.25 111.472 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 71.8 p -129.64 120.53 25.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.419 -0.355 . . . . 44.12 110.333 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -121.22 117.79 27.97 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.063 0.459 . . . . 75.44 112.019 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.8 m -98.82 116.86 31.99 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.902 0.382 . . . . 74.53 111.037 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.401 HD13 ' HG3' ' A' ' 3' ' ' MET . 42.6 mm -82.0 112.37 19.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 116.446 -0.343 . . . . 44.14 111.041 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 77' ' ' ARG . 19.3 mmm180 -78.86 101.6 7.76 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.936 0.398 . . . . 72.52 110.552 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.0 131.94 35.91 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.459 0.54 . . . . 72.22 112.459 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -65.04 116.39 6.4 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.84 -0.618 . . . . 75.54 109.8 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -121.31 168.37 11.71 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.707 0.632 . . . . 72.13 112.707 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -168.67 117.4 0.7 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.593 -0.73 . . . . 71.14 110.728 -177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -62.04 93.92 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.92 0.39 . . . . 73.45 110.731 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -63.13 163.82 9.51 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.008 0.744 . . . . 73.22 113.008 -176.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -98.41 -39.92 8.54 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.973 -0.558 . . . . 73.35 111.215 176.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 35.8 p80 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 119.268 -0.396 . . . . 73.12 111.674 179.845 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' HD13 ' A' ' 78' ' ' LEU . 75.3 mtm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.779 0.323 . . . . 74.03 111.468 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.585 ' HB2' ' HG3' ' A' ' 77' ' ' ARG . 39.8 mt-10 -124.32 163.09 22.42 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.281 0.563 . . . . 72.51 111.862 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.67 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 25.7 ttt -143.59 111.95 6.34 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.061 -0.518 . . . . 74.14 111.613 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.43 120.78 28.13 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.661 0.267 . . . . 71.32 111.043 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 44' ' ' ILE . 22.5 mt -124.64 147.64 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.876 0.37 . . . . 73.13 111.814 -174.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.05 110.37 8.44 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.429 -0.35 . . . . 74.51 110.987 170.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -89.28 124.18 34.17 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.825 -0.435 . . . . 71.24 109.825 172.057 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 58.2 ttt180 -124.24 125.44 44.4 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.024 0.44 . . . . 71.14 111.852 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 170.76 -168.12 41.24 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.846 -0.692 . . . . 43.31 113.608 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -123.07 90.17 3.24 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 122.666 0.386 . . . . 74.43 110.852 -179.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -175.95 142.26 0.51 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.149 -0.478 . . . . 62.3 110.372 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 35.0 tp -89.28 -39.63 13.35 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 111.853 0.316 . . . . 73.42 111.853 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -66.66 -32.26 73.46 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 122.17 -0.331 . . . . 73.32 111.251 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.69 -41.91 70.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.057 0.456 . . . . 74.13 110.909 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.467 ' CD1' HD22 ' A' ' 42' ' ' LEU . 62.4 t80 -58.83 -56.74 18.27 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.797 -0.638 . . . . 63.54 111.502 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.08 -52.33 63.11 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.144 0.424 . . . . 71.41 112.144 -176.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -62.43 -54.59 38.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.763 0.653 . . . . 74.53 112.763 -176.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.46 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.15 -43.86 87.59 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.92 0.391 . . . . 75.23 111.558 -178.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.2 tp -66.81 -42.54 85.75 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.975 0.417 . . . . 72.53 111.327 177.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -59.33 -52.77 64.23 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.155 -0.475 . . . . 53.33 111.985 -177.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -60.93 -49.59 76.85 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.203 0.445 . . . . 74.21 112.203 -176.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 51.4 mtp -62.94 -40.81 98.78 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.739 0.274 . . . . 44.02 111.739 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.3 mt -64.16 -41.92 93.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 120.974 0.416 . . . . 62.42 110.624 174.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.3 -46.53 79.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.061 -0.518 . . . . 72.34 111.136 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' A' ' 28' ' ' LYS . 26.2 mt-30 -74.3 -36.11 63.72 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.308 0.484 . . . . 71.4 112.308 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.86 -47.1 87.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.934 -0.479 . . . . 73.31 111.618 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -59.63 -39.49 84.49 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.744 0.646 . . . . 72.45 112.744 -177.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 20.8 ptmt -69.37 -14.33 62.85 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.987 0.422 . . . . 75.13 111.372 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -108.43 15.18 24.15 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.445 -0.343 . . . . 73.0 111.119 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.88 16.81 10.63 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.532 0.567 . . . . 74.54 112.532 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -78.43 133.31 12.61 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 121.442 -0.409 . . . . 52.13 113.587 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.7 m -90.85 122.5 33.61 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.542 -0.387 . . . . 75.54 111.117 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG22 HG12 ' A' ' 46' ' ' ILE . 49.9 t -109.03 130.17 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 120.96 0.41 . . . . 70.22 111.871 -179.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.9 t -124.64 132.79 53.4 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.519 -0.309 . . . . 74.42 110.794 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.524 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.7 p90 -128.34 144.92 51.19 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.369 0.507 . . . . 73.21 112.369 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 37.8 p -137.84 133.24 33.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.96 -0.564 . . . . 72.24 111.13 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.55 115.44 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.747 0.308 . . . . 72.2 111.31 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -114.21 81.39 1.53 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.383 0.611 . . . . 65.23 111.496 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.72 -85.09 0.03 OUTLIER Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.814 0.685 . . . . 55.31 114.814 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -100.06 -10.74 21.21 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.473 0.546 . . . . 51.31 112.473 -171.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -146.51 160.87 41.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.065 0.765 . . . . 71.42 113.065 -175.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 35' ' ' TYR . 50.6 tp -101.49 116.31 32.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.501 -0.772 . . . . 72.33 111.883 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB2' ' OG1' ' A' ' 36' ' ' THR . 38.0 mt-10 -79.83 129.96 34.92 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.536 -0.302 . . . . 70.2 110.725 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 5' ' ' ILE . 66.5 mt -134.58 121.86 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 122.407 0.283 . . . . 73.04 111.069 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 3' ' ' MET . 42.5 ttm180 -118.66 120.84 38.63 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.073 0.463 . . . . 61.2 111.032 174.559 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' ' 2' ' ' GLU . 49.7 mt -101.49 129.08 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 116.121 -0.49 . . . . 74.51 110.777 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.424 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 57.5 m -120.89 143.39 48.95 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.313 0.245 . . . . 71.41 111.6 -176.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.44 10.91 60.14 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.119 -0.562 . . . . 72.25 114.396 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.465 HG21 ' HE ' ' A' ' 54' ' ' ARG . 19.2 m -89.39 136.4 29.98 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 117.32 0.56 . . . . 74.43 112.077 179.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -73.09 174.32 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.976 2.451 . . . . 71.22 113.316 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 13.7 pt-20 -66.42 -49.38 66.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.624 0.972 . . . . 73.23 113.624 -171.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.21 -41.48 85.7 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.883 -0.51 . . . . 75.21 111.262 -176.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.59 -31.45 48.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.182 0.515 . . . . 70.31 110.992 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.67 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 3.8 tpm_? -52.51 -43.26 64.97 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 72.43 111.321 176.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.85 -52.85 62.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.811 -0.631 . . . . 62.43 111.68 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.74 -43.06 99.58 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.254 -0.43 . . . . 65.35 111.86 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.81 -36.77 84.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.961 0.41 . . . . 73.4 111.491 176.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.26 70.82 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.993 0.425 . . . . 65.35 111.328 176.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -78.3 -34.59 48.7 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 116.284 -0.416 . . . . 61.15 111.452 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.73 -41.49 97.71 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.776 0.287 . . . . 65.25 111.776 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -51.06 -43.59 60.99 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.103 0.478 . . . . 72.41 111.716 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.65 -41.68 95.48 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.117 -0.492 . . . . 73.33 111.416 176.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.1 tpt180 -62.71 -52.95 61.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.044 -0.526 . . . . 75.05 110.937 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 18' ' ' ALA . 86.4 mt -50.14 -48.54 53.68 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.89 -0.595 . . . . 71.1 111.998 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.46 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -58.78 -52.65 64.83 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.025 -0.534 . . . . 44.11 111.873 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -62.64 -35.05 78.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.601 0.593 . . . . 73.15 112.601 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.6 mm-40 -55.25 -47.69 75.06 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.251 0.548 . . . . 52.04 111.231 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -93.93 7.6 44.4 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.101 -0.499 . . . . 73.33 111.76 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 60.11 31.39 20.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.424 0.63 . . . . 71.31 111.559 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.5 pt -105.54 171.69 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.046 0.451 . . . . 64.34 111.23 177.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.45 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 47.8 p -97.99 143.04 28.97 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.928 0.394 . . . . 74.5 111.601 -179.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 11.1 p -128.62 120.75 53.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.488 0.661 . . . . 62.14 111.986 176.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.5 p -116.09 136.01 53.42 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.761 -0.654 . . . . 75.3 110.178 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -149.39 155.07 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.014 0.746 . . . . 75.1 113.014 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 49.8 m -131.82 132.04 43.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.524 -0.762 . . . . 72.44 110.644 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 HH11 ' A' ' 54' ' ' ARG . 41.8 mm -94.15 122.11 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.575 0.226 . . . . 74.14 111.168 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.585 ' HG3' ' HB2' ' A' ' 2' ' ' GLU . 14.9 ptm180 -113.53 130.85 56.27 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.482 0.658 . . . . 73.25 112.259 179.315 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.542 HD13 ' HG2' ' A' ' 1' ' ' MET . 16.7 tp -140.0 143.81 36.65 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.258 -0.883 . . . . 72.44 110.835 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -67.4 86.79 0.18 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.213 0.53 . . . . 74.21 111.002 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -96.19 121.71 38.25 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.021 -0.536 . . . . 72.35 111.484 -176.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -64.49 135.57 56.19 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.258 0.551 . . . . 70.21 111.185 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -121.9 106.33 11.15 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.061 -0.518 . . . . 73.35 111.293 -175.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -125.17 113.36 17.58 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.991 0.424 . . . . 62.41 111.501 -177.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -78.09 159.76 28.49 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.241 -0.436 . . . . 74.31 111.419 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 . . . . . 0 C--O 1.252 1.214 0 CA-C-N 116.644 -0.253 . . . . 63.25 111.051 175.148 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 tmm? . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.826 0.346 . . . . 64.31 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -109.66 146.25 35.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.314 -0.403 . . . . 71.32 111.043 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.8 ptm -144.36 119.09 9.83 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.825 0.345 . . . . 75.33 111.928 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.82 130.79 38.31 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.292 -0.413 . . . . 73.13 111.188 177.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.2 mt -132.95 112.84 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.376 -0.203 . . . . 71.03 111.38 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -102.73 121.74 43.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.861 0.362 . . . . 65.44 111.765 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -101.39 126.04 48.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.342 -0.39 . . . . 63.42 111.532 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -140.14 132.67 28.67 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.536 -0.302 . . . . 75.21 110.79 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.475 ' HA3' ' HB ' ' A' ' 70' ' ' ILE . . . 168.9 -173.68 43.45 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 119.977 -1.106 . . . . 75.41 114.72 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 2.5 m-20 -87.35 85.75 7.19 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.297 0.48 . . . . 65.14 112.297 -175.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 8.5 t70 178.77 164.92 0.84 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.968 0.507 . . . . 74.21 109.992 174.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.0 tp -113.76 -44.62 3.16 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.949 0.404 . . . . 54.01 111.035 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.55 -25.66 68.34 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.374 -0.376 . . . . 74.24 111.152 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.27 -29.03 30.85 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.81 0.338 . . . . 65.32 111.51 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.402 ' CE1' HD11 ' A' ' 37' ' ' LEU . 73.0 t80 -57.11 -60.15 4.03 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.133 0.492 . . . . 65.41 111.067 174.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 11.7 pt-20 -69.54 -38.56 77.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.319 -0.401 . . . . 72.51 111.567 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.443 ' HG3' ' HZ ' ' A' ' 68' ' ' PHE . 24.1 mmmt -56.75 -54.22 48.79 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 52.2 112.075 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.22 69.36 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.919 0.39 . . . . 72.23 111.846 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.7 -49.48 72.94 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.164 0.431 . . . . 53.4 112.164 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.0 tptp -61.37 -50.63 72.12 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.819 0.342 . . . . 75.54 111.672 -174.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -62.14 -43.82 98.0 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.0 0.37 . . . . 73.11 112.0 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -59.83 -45.38 92.56 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.631 0.253 . . . . 64.35 111.211 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.0 mt -63.26 -42.4 96.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.96 0.41 . . . . 74.01 110.918 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.28 -39.09 74.97 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.08 -0.509 . . . . 71.51 111.156 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -75.77 -50.2 15.94 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.072 0.397 . . . . 72.24 112.072 174.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.63 84.91 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.009 0.744 . . . . 75.13 113.009 -175.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.95 58.97 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.733 0.301 . . . . 64.54 111.701 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -54.86 -33.09 61.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.198 0.523 . . . . 74.51 111.073 175.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -111.91 -168.23 1.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.953 -0.567 . . . . 72.13 111.227 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 16.98 2.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.95 0.405 . . . . 73.52 111.778 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.84 108.19 2.78 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.452 -0.404 . . . . 45.05 113.331 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -82.9 135.49 34.9 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.8 -0.235 . . . . 72.14 110.988 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.6 t -113.28 125.32 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 112.256 0.465 . . . . 71.0 112.256 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 t -122.57 152.5 40.35 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.129 -0.487 . . . . 61.13 110.445 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.51 ' HB2' HD11 ' A' ' 42' ' ' LEU . 38.1 p90 -144.63 141.71 29.58 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.361 0.504 . . . . 71.32 112.361 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.0 p -133.91 135.8 43.85 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.287 -0.415 . . . . 65.21 111.152 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.402 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.58 127.56 35.26 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.596 0.236 . . . . 61.43 111.53 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -123.16 94.15 4.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.132 0.492 . . . . 74.31 111.645 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.78 -75.54 0.72 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.303 -0.475 . . . . 73.43 113.718 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -139.75 11.38 2.47 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.523 0.564 . . . . 73.13 112.523 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -137.47 159.97 40.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.392 0.615 . . . . 75.22 112.446 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 35' ' ' TYR . 58.0 tp -105.7 119.21 38.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.667 -0.697 . . . . 64.34 111.823 -179.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.506 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 29.7 mt-10 -91.18 104.14 16.74 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.459 -0.337 . . . . 64.03 111.233 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.49 109.61 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 120.691 0.281 . . . . 74.1 111.578 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 45' ' ' ARG . 31.1 ttp180 -110.93 125.99 54.25 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.076 0.465 . . . . 72.03 111.666 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.0 mt -108.12 139.53 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 116.415 -0.357 . . . . 62.14 110.808 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.8 m -120.42 130.61 54.42 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.386 0.513 . . . . 72.05 112.386 -175.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.75 40.53 45.15 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.907 0.723 . . . . 64.43 114.907 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.8 m -95.23 152.85 39.69 Favored Pre-proline 0 N--CA 1.469 0.516 0 O-C-N 122.302 -0.529 . . . . 74.53 111.592 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.465 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 11.3 Cg_endo -55.11 117.16 3.72 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.779 2.319 . . . . 74.43 112.724 176.222 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.39 -29.97 11.29 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.955 0.724 . . . . 72.21 112.955 -178.001 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.457 ' O ' ' HE3' ' A' ' 55' ' ' LYS . 29.8 pt20 -76.11 -46.59 28.08 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.142 0.423 . . . . 73.41 112.142 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.465 ' HB ' ' HG2' ' A' ' 50' ' ' PRO . 58.8 t -67.61 -19.94 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-O 121.31 0.576 . . . . 51.3 110.844 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 7.0 ttp180 -46.17 -33.58 3.69 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.688 -0.687 . . . . 73.42 112.374 175.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 52' ' ' GLN . 17.1 ptpt -60.29 -45.11 94.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.715 0.293 . . . . 72.51 111.455 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -74.84 -34.15 62.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.744 0.307 . . . . 73.54 111.18 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.36 -48.38 78.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.906 0.384 . . . . 62.34 111.248 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.04 -38.97 83.14 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.082 0.468 . . . . 60.42 110.982 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -58.77 -43.46 90.4 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.805 -0.634 . . . . 73.43 111.136 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -60.26 -42.35 95.17 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.124 -0.489 . . . . 73.5 110.996 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.462 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -53.84 -49.03 69.33 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.967 0.413 . . . . 72.51 111.618 177.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.34 -36.37 83.49 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.072 0.463 . . . . 52.23 111.259 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -69.08 -37.01 78.23 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.358 -0.383 . . . . 64.15 111.333 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 61' ' ' ALA . 79.7 mt -59.57 -44.01 93.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.277 0.56 . . . . 54.15 110.223 174.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.88 -48.55 81.29 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.78 -0.646 . . . . 40.33 111.038 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -60.58 -33.79 73.24 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.306 0.484 . . . . 72.23 112.306 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -57.56 -36.86 72.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.12 0.486 . . . . 75.1 111.049 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.443 ' HZ ' ' HG3' ' A' ' 17' ' ' LYS . 85.4 m-85 -111.05 7.06 21.34 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.204 -0.453 . . . . 74.05 111.25 177.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 55.58 28.51 11.99 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.06 0.544 . . . . 74.32 112.151 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.475 ' HB ' ' HA3' ' A' ' 9' ' ' GLY . 32.2 pt -95.18 -178.25 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 112.675 0.62 . . . . 74.31 112.675 -176.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.1 m -91.79 141.37 28.74 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.97 -0.559 . . . . 61.31 111.694 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.41 118.71 23.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.041 0.448 . . . . 63.51 111.237 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -115.22 120.84 41.05 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.266 -0.271 . . . . 64.34 110.469 177.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -127.92 137.3 52.24 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.301 0.572 . . . . 62.42 112.308 -175.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.0 m -113.74 111.67 22.18 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.001 -0.545 . . . . 52.13 110.822 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -123.03 116.01 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.725 0.297 . . . . 65.24 111.312 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -117.67 119.42 34.9 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 122.522 0.329 . . . . 70.01 110.757 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.472 ' N ' HD22 ' A' ' 78' ' ' LEU . 3.0 mm? -89.11 164.64 14.94 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.22 0.533 . . . . 65.03 112.016 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 81' ' ' HIS . 1.0 OUTLIER -75.07 147.26 40.8 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.185 -0.462 . . . . 64.23 110.501 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -128.12 -48.52 1.33 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.483 0.549 . . . . 73.41 112.483 -174.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' HIS . . . . . 0.422 ' HB2' ' OE1' ' A' ' 79' ' ' GLU . 74.9 t60 50.46 25.27 1.87 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.775 1.028 . . . . 70.52 113.775 177.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -55.67 115.34 2.29 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.45 -0.782 . . . . 70.25 111.336 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -74.15 132.45 42.24 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.018 0.437 . . . . 70.41 111.656 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 34.7 p80 -108.32 -179.11 3.79 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.191 -0.459 . . . . 74.24 111.45 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 31.3 m170 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 119.017 -0.516 . . . . 75.33 110.894 174.385 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.835 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.9 mtp . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.01 0.433 . . . . 62.2 111.382 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' A' ' 77' ' ' ARG . 0.6 OUTLIER -122.51 119.11 29.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.791 -0.818 . . . . 74.32 108.791 178.098 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.583 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.0 ttt -124.38 122.21 37.06 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.017 1.117 . . . . 75.51 114.017 -165.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' A' ' 75' ' ' THR . 1.0 OUTLIER -89.61 123.94 34.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.314 -0.857 . . . . 72.3 110.272 171.415 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 41.0 mt -130.4 108.73 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.958 0.409 . . . . 74.5 111.257 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -109.49 108.04 18.38 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.428 0.529 . . . . 53.5 112.428 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -89.84 156.04 18.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.836 -0.62 . . . . 74.14 110.708 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.537 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 42.1 ttp180 -142.42 120.4 12.06 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.171 0.51 . . . . 73.32 111.387 171.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.94 131.53 2.38 Favored Glycine 0 CA--C 1.522 0.507 0 CA-C-N 115.826 -0.625 . . . . 40.24 112.493 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.68 -5.44 55.15 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 122.427 -0.455 . . . . 64.43 111.654 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 14' ' ' ALA . 9.6 m-20 -73.02 101.22 3.18 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 73.01 110.709 174.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 30.4 tp -61.97 -26.98 68.53 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.046 0.387 . . . . 74.23 112.046 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -73.44 -36.35 65.89 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.024 -0.423 . . . . 73.4 110.527 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 11' ' ' ASP . . . -66.74 -31.75 72.6 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.893 0.378 . . . . 73.1 110.819 175.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.451 ' HE1' HD13 ' A' ' 42' ' ' LEU . 60.6 t80 -55.26 -48.17 74.38 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.114 0.483 . . . . 75.21 110.331 171.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 9.0 tm-20 -60.45 -50.42 73.66 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.824 -0.626 . . . . 74.11 110.86 176.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -56.63 -54.35 47.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.403 0.52 . . . . 74.32 112.403 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -56.17 -53.36 58.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.891 0.33 . . . . 70.2 111.891 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.48 -36.74 83.45 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.061 0.458 . . . . 73.52 110.786 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.9 tptm -59.03 -51.05 71.72 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.041 -0.527 . . . . 72.34 111.73 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.577 ' HG3' HD21 ' A' ' 64' ' ' LEU . 7.8 mm-40 -61.65 -47.52 85.0 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.913 -0.585 . . . . 72.53 111.82 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.521 ' HB3' HD11 ' A' ' 46' ' ' ILE . 51.3 mmm -61.88 -40.38 95.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.781 0.324 . . . . 74.31 111.301 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.0 mt -67.79 -37.58 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 120.787 0.327 . . . . 72.21 110.867 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 21' ' ' GLU . 60.2 ttp85 -54.91 -42.5 72.25 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.884 0.373 . . . . 74.31 111.094 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -74.19 -48.04 31.73 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.951 0.405 . . . . 72.43 111.509 175.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.77 -46.66 71.04 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.752 0.649 . . . . 71.45 112.752 -175.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -56.4 -34.3 66.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 75.53 111.603 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -72.84 -32.63 65.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.072 0.463 . . . . 63.34 111.372 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.43 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 24.9 m-85 -96.35 -6.28 38.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.321 -0.399 . . . . 74.35 111.854 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 62.12 27.21 16.4 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.126 0.489 . . . . 64.1 111.516 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.94 156.87 36.75 Favored Glycine 0 CA--C 1.527 0.802 0 CA-C-N 116.126 -0.488 . . . . 74.12 113.262 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 78.0 m -88.32 128.66 35.49 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.731 -0.276 . . . . 74.22 110.949 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.509 HG22 HG12 ' A' ' 46' ' ' ILE . 61.1 t -123.78 114.47 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 121.047 0.451 . . . . 75.13 112.054 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.8 t -106.53 154.4 20.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.274 -0.421 . . . . 70.43 110.464 173.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.593 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 41.1 p90 -145.67 138.08 25.66 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.094 0.473 . . . . 74.23 112.144 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.8 p -132.9 134.43 44.56 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.119 -0.491 . . . . 74.52 111.049 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.57 100.91 12.32 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.777 0.322 . . . . 52.55 111.133 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -97.61 97.58 9.17 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.828 0.346 . . . . 73.04 110.864 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 -78.04 0.13 Allowed Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.357 -0.449 . . . . 62.24 113.055 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.8 p30 -143.31 15.81 1.86 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.541 -0.388 . . . . 74.12 111.342 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' ' HD3' ' A' ' 8' ' ' ARG . 3.9 m-20 -107.17 128.67 54.61 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.217 -0.447 . . . . 74.45 111.211 177.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.451 HD13 ' HE1' ' A' ' 15' ' ' PHE . 46.8 tp -95.5 101.72 13.46 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.278 0.561 . . . . 54.23 111.358 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.593 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.7 tt0 -89.53 107.18 18.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.108 -0.497 . . . . 74.53 111.642 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.8 mt -113.07 117.62 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 122.624 0.369 . . . . 71.35 110.88 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 4' ' ' ASP . 74.0 mtt180 -116.86 122.92 45.75 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.823 -0.548 . . . . 71.02 111.865 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 22' ' ' MET . 51.2 mt -110.0 115.06 48.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.995 -0.548 . . . . 71.12 111.593 -176.162 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 2' ' ' GLU . 60.4 m -100.48 127.01 46.94 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.116 -0.493 . . . . 74.23 111.548 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.43 57.29 1.13 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 121.152 -0.547 . . . . 62.44 113.627 175.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.515 HG23 ' HB2' ' A' ' 1' ' ' MET . 18.5 m -118.11 138.73 25.81 Favored Pre-proline 0 CA--C 1.541 0.63 0 CA-C-O 120.748 0.309 . . . . 52.31 111.445 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 16.8 Cg_exo -68.14 140.46 49.49 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.008 2.472 . . . . 75.43 113.389 -177.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.835 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 11.6 pt-20 -54.64 -41.08 69.63 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.73 0.641 . . . . 44.43 112.73 -178.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -66.14 -24.09 66.6 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.271 0.471 . . . . 73.55 112.271 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.528 HG12 ' HG ' ' A' ' 57' ' ' LEU . 40.1 t -84.53 -10.19 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-O 120.912 0.387 . . . . 75.04 111.684 -177.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' HD12 ' A' ' 76' ' ' ILE . 4.1 tpt180 -43.73 -45.17 6.99 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.641 0.377 . . . . 72.44 111.989 175.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.96 -31.44 72.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.157 -0.474 . . . . 73.23 111.836 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -77.07 -53.85 7.27 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.873 0.368 . . . . 70.51 111.694 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.528 ' HG ' HG12 ' A' ' 53' ' ' VAL . 82.5 mt -56.0 -53.52 55.9 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.582 0.586 . . . . 75.31 112.582 -174.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.18 -40.6 94.5 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.966 0.413 . . . . 51.42 111.51 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -62.66 -40.94 98.62 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.319 -0.4 . . . . 71.03 111.539 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -74.2 -34.8 63.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.826 0.346 . . . . 75.31 111.262 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.71 -47.49 85.43 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.911 0.386 . . . . 55.11 110.879 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.48 -31.47 71.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.43 -0.35 . . . . 73.12 111.34 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -55.59 -53.37 57.35 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.981 -0.377 . . . . 74.42 109.981 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.577 HD21 ' HG3' ' A' ' 21' ' ' GLU . 54.4 mt -49.87 -43.08 49.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.925 -0.579 . . . . 64.24 112.047 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -57.39 12.88 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.001 0.429 . . . . 44.41 111.577 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -69.6 -28.21 65.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 120.999 0.428 . . . . 44.21 111.828 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.73 -36.99 59.78 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.07 0.548 . . . . 70.1 111.805 -176.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -111.56 7.49 20.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 120.896 0.379 . . . . 64.01 111.883 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 66.24 13.38 9.14 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.36 0.664 . . . . 75.32 112.088 176.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.7 pt -88.64 178.26 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 116.55 -0.295 . . . . 63.12 111.186 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.537 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 57.0 p -107.1 156.06 19.19 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.063 0.459 . . . . 72.13 112.144 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.78 131.8 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 121.35 0.595 . . . . 71.15 111.686 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.8 p -132.05 121.76 24.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.154 -0.475 . . . . 72.11 110.072 174.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -129.49 130.06 45.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.903 0.705 . . . . 73.4 112.903 -176.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.496 ' O ' ' HB3' ' A' ' 4' ' ' ASP . 68.3 m -113.84 121.91 45.45 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.683 -0.689 . . . . 54.02 110.783 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.583 HG12 ' HG3' ' A' ' 3' ' ' MET . 25.1 mt -101.08 126.83 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.128 0.49 . . . . 72.32 112.306 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 26.0 mmm180 -75.4 100.65 4.51 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.129 -0.487 . . . . 71.22 110.917 175.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.5 tt -123.7 114.2 19.63 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.982 0.42 . . . . 73.32 109.993 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -71.79 134.11 45.96 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.442 0.534 . . . . 70.04 112.442 -177.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -71.33 89.0 0.88 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.403 -0.591 . . . . 45.32 109.403 172.564 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -75.45 1.09 14.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.254 0.835 . . . . 73.14 113.254 -166.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -123.13 91.55 3.51 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 122.137 -0.352 . . . . 70.41 110.268 171.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -59.26 -50.17 75.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.371 -0.377 . . . . 75.23 111.823 -172.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -71.26 97.98 1.66 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.054 0.454 . . . . 70.13 111.66 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 . . . . . 0 C--O 1.256 1.423 0 C-N-CA 123.374 0.67 . . . . 62.25 112.557 -177.983 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.578 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 69.3 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.836 0.351 . . . . 70.3 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.74 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 40.2 mt-10 -95.2 132.92 39.63 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 109.711 -0.477 . . . . 72.34 109.711 170.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.504 ' O ' ' HA ' ' A' ' 45' ' ' ARG . 23.8 ttt -114.49 106.54 14.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.988 0.423 . . . . 70.43 110.23 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 12.5 t70 -99.67 108.44 20.8 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.197 -0.456 . . . . 35.34 111.241 -172.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 58.6 mt -127.83 111.81 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 116.426 -0.352 . . . . 73.35 110.654 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -118.32 119.79 35.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.343 0.592 . . . . 75.51 112.265 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -94.17 155.53 17.01 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.802 -0.635 . . . . 73.21 111.237 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -124.13 120.02 31.13 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.888 0.375 . . . . 75.05 110.192 168.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.9 135.36 10.71 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.945 -0.645 . . . . 74.21 113.306 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.41 -43.68 59.97 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.849 0.357 . . . . 72.14 111.667 177.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -88.58 -171.48 3.35 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.067 0.46 . . . . 74.23 112.124 -178.574 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 54.1 tp -95.93 -52.55 4.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.545 0.572 . . . . 74.34 112.545 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -61.58 -26.75 68.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.932 0.716 . . . . 64.44 112.932 -172.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.5 -30.98 44.01 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.978 0.418 . . . . 43.12 111.026 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -59.77 -57.8 11.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.845 -0.616 . . . . 71.04 111.365 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.59 -51.16 59.48 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.131 0.419 . . . . 64.33 112.131 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 35.8 mmtp -55.27 -54.31 45.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.435 -0.348 . . . . 75.13 111.721 -176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.72 -51.99 59.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.972 0.36 . . . . 63.25 111.972 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.488 ' HB2' HD21 ' A' ' 42' ' ' LEU . 67.2 tp -55.88 -48.53 75.41 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.369 -0.378 . . . . 72.12 111.822 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -62.35 -40.84 97.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.248 0.462 . . . . 62.14 112.248 -176.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 18.6 mm-40 -60.05 -51.56 69.1 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.624 0.25 . . . . 71.51 111.174 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.4 mtp -59.38 -44.57 92.75 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.019 0.438 . . . . 72.31 111.268 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 54.0 mt -60.37 -37.15 73.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.407 -0.36 . . . . 62.4 111.219 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -57.73 -53.38 58.89 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.836 0.35 . . . . 75.24 111.397 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -68.55 -41.61 79.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.852 0.316 . . . . 63.14 111.852 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.5 96.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.736 0.643 . . . . 74.24 112.736 -176.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 27' ' ' ARG . 28.5 mtp85 -60.04 -27.53 67.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.626 0.602 . . . . 72.24 112.626 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -58.16 -23.95 57.14 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.399 0.618 . . . . 70.43 110.965 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -114.21 -164.6 0.94 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.949 -0.569 . . . . 72.22 110.706 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.11 9.83 11.65 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.88 0.371 . . . . 53.22 111.599 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.25 86.95 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 CA-C-N 116.198 -0.456 . . . . 71.44 113.589 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 m -71.55 117.03 12.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.806 0.336 . . . . 71.53 110.963 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 56.6 t -99.19 125.23 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.38 0.511 . . . . 64.45 112.38 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.1 t -121.14 138.53 54.16 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.302 -0.408 . . . . 74.22 110.799 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.558 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.2 p90 -134.19 137.15 44.22 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.366 0.506 . . . . 75.05 112.366 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 p -124.35 138.96 54.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.198 -0.455 . . . . 72.13 111.187 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -108.08 131.6 54.43 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.045 0.45 . . . . 51.5 111.918 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -145.01 119.96 9.99 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.294 -0.412 . . . . 53.13 110.588 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 -86.72 0.07 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.105 -0.569 . . . . 73.51 112.99 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -144.92 10.77 1.36 Allowed 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.042 0.449 . . . . 71.32 111.45 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -95.32 122.78 38.38 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.165 -0.47 . . . . 74.33 111.514 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 19' ' ' LEU . 33.6 tp -96.45 103.92 15.86 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.138 -0.483 . . . . 65.4 110.578 173.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.2 mt-10 -90.08 104.46 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.353 -0.385 . . . . 75.52 111.464 -177.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -105.24 109.46 27.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.73 0.3 . . . . 74.3 111.451 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 3' ' ' MET . 37.9 ttm180 -111.82 115.27 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.86 -0.525 . . . . 75.42 111.364 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 44.7 mt -92.99 137.03 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.206 -0.452 . . . . 72.22 110.508 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.9 m -125.51 125.2 42.88 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 111.862 0.319 . . . . 62.44 111.862 -175.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.16 58.93 1.91 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.362 -0.447 . . . . 72.5 114.143 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 18.5 m -117.16 144.63 34.1 Favored Pre-proline 0 N--CA 1.474 0.735 0 O-C-N 122.248 -0.56 . . . . 74.01 111.912 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.66 130.73 32.57 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.412 2.075 . . . . 71.12 111.626 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.18 -28.58 62.94 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.533 0.938 . . . . 72.35 113.533 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -68.1 -38.01 81.81 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 122.062 -0.399 . . . . 73.45 111.287 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -77.69 -27.23 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 121.129 0.49 . . . . 64.3 110.89 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.578 ' NH1' ' SD ' ' A' ' 1' ' ' MET . 50.3 ttp180 -49.0 -38.7 24.09 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.74 -0.664 . . . . 71.33 111.517 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -60.18 -49.09 79.01 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.166 -0.47 . . . . 74.4 111.751 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -66.98 -41.51 86.68 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.08 -0.509 . . . . 64.3 112.285 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.33 -42.96 99.54 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.864 0.364 . . . . 63.1 111.312 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.36 94.95 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.224 0.535 . . . . 72.44 111.138 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -67.93 -31.14 70.69 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.836 -0.62 . . . . 64.33 111.541 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.77 -33.32 70.65 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.977 0.418 . . . . 63.42 110.39 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.4 91.87 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.121 0.486 . . . . 52.02 110.925 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.95 -41.74 92.5 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.353 0.596 . . . . 71.13 110.534 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -57.16 -48.99 77.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.76 -0.654 . . . . 75.45 111.087 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.57 -40.23 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.174 -0.466 . . . . 74.22 111.392 177.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.45 -49.01 78.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.192 -0.458 . . . . 64.22 111.279 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.14 -33.82 76.92 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.938 0.399 . . . . 72.14 111.271 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.39 -55.24 29.78 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.186 -0.461 . . . . 75.11 111.489 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -93.24 2.52 56.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.272 0.471 . . . . 73.54 112.272 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m120 58.63 31.87 21.56 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.068 0.461 . . . . 74.52 111.297 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 29.2 pt -103.88 171.55 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-O 121.148 0.499 . . . . 62.24 112.004 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 97.7 m -98.49 141.37 31.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.106 -0.497 . . . . 53.03 111.301 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -147.54 142.99 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.41 -0.359 . . . . 72.45 111.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.1 p -118.71 147.88 43.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.751 0.31 . . . . 43.43 110.78 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.4 p90 -143.82 123.9 13.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.122 0.487 . . . . 72.25 111.969 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.9 m -131.81 143.61 50.32 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 116.381 -0.372 . . . . 65.22 111.4 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.31 105.66 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-O 121.197 0.522 . . . . 65.11 111.545 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.74 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 19.6 mtp180 -83.52 104.95 14.07 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.328 0.585 . . . . 63.54 111.209 178.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD22 ' HG2' ' A' ' 1' ' ' MET . 1.5 tm? -91.77 111.96 23.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.985 -0.552 . . . . 72.03 110.763 -177.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -92.41 130.4 38.1 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 120.845 0.355 . . . . 73.4 111.101 174.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.6 t60 178.97 123.45 0.05 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.686 -0.688 . . . . 74.21 110.35 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -61.27 96.31 0.05 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.193 0.521 . . . . 74.02 111.761 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -102.67 120.45 40.59 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.063 -0.517 . . . . 64.5 110.461 174.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -59.66 102.77 0.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.028 0.442 . . . . 63.22 111.344 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -69.53 137.2 52.27 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.185 -0.461 . . . . 74.12 111.507 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--O 1.254 1.317 0 CA-C-O 118.752 -0.642 . . . . 74.31 111.382 175.551 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tmm? . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 110.298 -0.26 . . . . 51.44 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.549 ' HG2' HG23 ' A' ' 47' ' ' THR . 36.3 mt-10 -135.88 140.99 44.53 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.864 0.466 . . . . 70.51 110.714 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 14.8 ptm -144.23 120.06 10.57 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.202 0.445 . . . . 74.5 112.202 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.626 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 29.4 m-20 -90.67 104.63 17.19 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.548 -0.296 . . . . 64.03 110.919 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.3 mt -103.8 109.2 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.726 0.298 . . . . 62.01 110.936 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 4.8 ptp180 -108.47 125.61 51.97 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.256 0.55 . . . . 74.12 112.26 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -102.85 132.06 49.31 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.475 -0.784 . . . . 52.13 111.371 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -142.94 119.9 11.32 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.578 0.228 . . . . 71.21 110.665 174.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.86 160.28 30.22 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 120.826 -0.702 . . . . 74.45 113.312 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -86.3 89.05 7.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.968 0.414 . . . . 75.44 112.006 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -165.33 165.64 19.27 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.067 -0.515 . . . . 74.22 109.996 173.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -106.85 -52.16 2.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.673 0.273 . . . . 65.12 111.6 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.58 -25.6 62.26 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.313 0.486 . . . . 54.13 112.313 -178.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.53 -30.17 40.37 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.078 0.399 . . . . 72.11 112.078 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CE1' HD21 ' A' ' 37' ' ' LEU . 59.7 t80 -58.96 -60.22 4.21 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.821 0.343 . . . . 71.42 111.178 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.74 -44.4 86.02 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.225 -0.443 . . . . 64.44 111.285 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.11 -56.13 26.03 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.081 -0.509 . . . . 62.1 112.084 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -44.33 96.13 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.119 0.485 . . . . 52.45 111.624 -177.007 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 23' ' ' ILE . 45.0 tp -62.09 -56.16 21.69 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.93 -0.577 . . . . 63.41 111.779 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -63.09 -41.21 99.34 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.127 0.417 . . . . 52.2 112.127 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -54.97 -47.72 74.2 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.609 0.242 . . . . 71.33 111.515 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 45.0 mtp -72.77 -36.39 67.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.667 0.27 . . . . 74.4 111.552 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 19' ' ' LEU . 63.7 mt -57.29 -34.53 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.739 0.304 . . . . 75.5 111.274 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 24' ' ' ARG . 37.1 ttp180 -48.92 -46.72 43.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.304 -0.407 . . . . 71.21 111.577 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -74.46 -43.54 55.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.633 0.254 . . . . 73.02 111.297 174.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.08 -34.57 63.74 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.639 0.607 . . . . 71.51 112.639 -177.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 6.5 mmp_? -60.53 -28.98 68.83 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.759 0.314 . . . . 72.3 111.65 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' HE3' ' N ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.61 -13.22 60.62 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.412 0.285 . . . . 62.0 111.746 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.73 151.54 28.81 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.211 0.529 . . . . 73.03 112.043 -177.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.21 57.05 1.05 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.015 0.436 . . . . 63.02 111.233 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.52 -168.26 12.98 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.344 -0.455 . . . . 52.51 113.491 -177.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 95.8 m -103.83 127.83 51.3 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.619 -0.342 . . . . 73.44 111.751 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.7 t -131.84 110.84 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.756 0.312 . . . . 74.41 110.705 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.3 t -121.76 162.5 20.73 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.922 0.391 . . . . 61.12 111.767 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.595 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 30.3 p90 -156.41 139.44 15.42 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.083 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 t -137.09 133.75 35.71 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.573 0.582 . . . . 73.14 112.573 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.403 HD21 ' CE1' ' A' ' 15' ' ' PHE . 3.6 mm? -94.19 102.21 14.23 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.072 -0.513 . . . . 70.24 110.99 176.31 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -118.27 106.0 12.33 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.065 0.459 . . . . 73.33 111.013 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.54 -85.22 0.44 Allowed Glycine 0 CA--C 1.525 0.695 0 C-N-CA 121.208 -0.52 . . . . 55.0 112.808 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -146.14 15.39 1.33 Allowed 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.763 0.316 . . . . 74.4 111.545 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -117.66 130.28 56.26 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.47 -0.332 . . . . 71.2 110.856 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 48.8 tp -102.94 102.6 12.68 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.437 -0.347 . . . . 73.03 111.271 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 27.3 mm-40 -87.97 106.57 18.21 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.515 -0.311 . . . . 50.03 111.177 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.41 HD11 HD21 ' A' ' 42' ' ' LEU . 54.1 mt -111.69 110.23 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 120.557 0.218 . . . . 73.12 111.001 177.114 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.3 ttt85 -107.1 122.6 46.8 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.945 -0.472 . . . . 73.42 111.721 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.5 mt -106.89 127.84 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 116.094 -0.503 . . . . 73.14 110.407 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -130.14 128.41 41.73 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.284 0.476 . . . . 71.23 112.284 -174.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.82 32.55 7.93 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 114.613 0.605 . . . . 45.0 114.613 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.67 141.44 24.65 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 117.506 0.653 . . . . 64.44 111.326 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.491 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 21.2 Cg_endo -59.14 133.62 54.21 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.797 2.331 . . . . 73.15 112.974 -178.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -59.58 -25.35 64.52 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.354 0.501 . . . . 71.42 112.354 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 50' ' ' PRO . 29.0 pt20 -60.34 -34.09 73.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.76 0.314 . . . . 75.13 111.743 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.456 HG23 ' HG3' ' A' ' 52' ' ' GLN . 42.9 t -91.49 -24.42 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.001 0.429 . . . . 75.21 110.827 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.624 ' HD3' HD13 ' A' ' 76' ' ' ILE . 5.9 tmm_? -47.88 -41.82 25.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.016 0.527 . . . . 64.42 111.49 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -61.2 -42.51 98.72 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.872 0.368 . . . . 74.44 111.81 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -66.0 -45.39 81.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.883 0.373 . . . . 72.53 110.684 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.34 -43.68 83.61 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.143 0.497 . . . . 72.42 111.247 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -64.07 -46.21 85.32 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.072 -0.513 . . . . 72.24 111.719 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -71.64 -34.19 69.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.19 0.441 . . . . 73.02 112.19 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.95 -37.16 86.39 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.169 0.509 . . . . 70.03 109.988 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -63.51 -38.79 92.48 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.889 -0.596 . . . . 64.1 111.163 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 45.5 mt-10 -58.07 -40.89 82.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.858 0.361 . . . . 75.55 110.968 175.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -61.24 -44.43 97.26 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.653 -0.249 . . . . 74.45 111.032 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.535 HD12 ' HA ' ' A' ' 61' ' ' ALA . 81.4 mt -50.46 -40.85 51.95 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.076 0.465 . . . . 75.44 111.127 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.613 ' HB2' HG12 ' A' ' 72' ' ' VAL . . . -65.8 -56.85 9.78 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.198 -0.455 . . . . 53.23 111.73 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.35 -23.92 67.11 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.19 -0.459 . . . . 72.02 112.087 -177.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -82.44 -56.23 4.01 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.1 0.476 . . . . 74.41 111.431 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -94.05 4.61 53.66 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.153 0.427 . . . . 73.51 112.153 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 61.81 20.26 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.439 0.533 . . . . 61.22 112.439 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 23.8 pt -90.17 153.13 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 116.282 -0.417 . . . . 63.04 111.366 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.5 m -87.98 122.22 31.32 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.257 -0.277 . . . . 74.23 111.252 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.613 HG12 ' HB2' ' A' ' 65' ' ' ALA . 12.5 p -123.88 133.62 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.26 0.552 . . . . 71.22 111.591 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 p -142.62 142.02 32.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.219 -0.446 . . . . 72.11 110.713 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.626 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 13.6 p90 -137.24 128.59 28.14 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.822 0.675 . . . . 73.05 112.822 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.4 m -102.78 123.86 47.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.89 -0.596 . . . . 72.23 110.197 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.624 HD13 ' HD3' ' A' ' 54' ' ' ARG . 34.3 mt -122.99 139.46 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.78 0.659 . . . . 51.22 112.78 -169.525 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' A' ' 77' ' ' ARG . 14.0 ptm180 -143.22 173.31 11.7 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.982 -0.554 . . . . 75.35 110.781 174.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 pp -156.84 167.39 30.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.105 0.479 . . . . 63.02 111.884 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.431 ' H ' ' CD ' ' A' ' 79' ' ' GLU . 1.2 pm0 -75.83 85.19 2.8 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.288 0.566 . . . . 73.12 110.775 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -57.9 105.74 0.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.937 -0.574 . . . . 74.54 111.223 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -53.59 113.55 1.22 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.322 0.86 . . . . 74.34 113.322 -171.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -110.23 -177.0 3.13 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.22 -0.446 . . . . 75.13 110.664 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -165.24 138.66 4.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.166 0.432 . . . . 62.34 112.166 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -78.55 144.79 35.27 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.034 -0.53 . . . . 70.02 110.654 174.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.7 m80 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.856 -0.593 . . . . 71.11 111.919 179.041 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 47.8 ttp . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.562 0.22 . . . . 72.3 110.826 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -125.8 153.51 43.95 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.245 0.461 . . . . 73.32 112.245 -175.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -148.29 112.14 5.11 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.951 -0.568 . . . . 73.12 110.979 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.581 ' HB3' ' HG2' ' A' ' 45' ' ' ARG . 2.3 p-10 -99.11 119.8 38.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.525 0.678 . . . . 74.51 111.866 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.515 HD13 ' HB2' ' A' ' 61' ' ' ALA . 56.4 mt -111.61 114.83 48.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 115.98 -0.555 . . . . 73.03 111.576 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.411 ' HD3' ' OD2' ' A' ' 41' ' ' ASP . 1.3 tmm_? -101.13 112.52 25.01 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.987 0.423 . . . . 73.04 111.549 -177.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 97.8 m-85 -91.19 156.04 18.14 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.75 0.309 . . . . 62.4 111.555 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 65.1 ttt180 -139.91 121.52 15.25 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.586 -0.279 . . . . 73.25 111.206 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.25 163.82 36.73 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.164 -0.541 . . . . 53.33 113.262 178.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -87.31 -35.74 18.25 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.946 0.403 . . . . 73.34 111.525 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.7 119.68 9.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.047 -0.524 . . . . 73.44 112.036 -177.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.95 -39.86 93.57 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.076 0.465 . . . . 71.22 110.87 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 1.8 mp0 -61.9 -27.88 69.13 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.091 -0.504 . . . . 74.33 111.744 177.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' A' ' 70' ' ' ILE . . . -58.97 -39.65 82.38 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.828 0.347 . . . . 75.54 111.13 177.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -67.89 -53.92 22.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.33 -0.396 . . . . 75.52 111.642 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.0 pt-20 -62.38 -42.56 99.51 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.1 0.407 . . . . 51.13 112.1 -177.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.499 ' NZ ' ' HB3' ' A' ' 17' ' ' LYS . 4.2 mmmp? -65.29 -42.62 92.93 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 122.296 -0.252 . . . . 74.25 111.437 178.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.525 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -62.24 -47.54 83.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.209 0.528 . . . . 72.02 111.432 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.14 -43.99 97.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.975 -0.557 . . . . 63.45 111.146 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -60.95 -48.31 82.4 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.246 -0.434 . . . . 74.34 111.593 -178.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -57.95 -53.21 60.75 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.915 0.339 . . . . 73.14 111.915 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.418 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.3 mmm -59.55 -48.6 81.03 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.774 0.321 . . . . 72.52 111.704 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.608 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.8 mt -64.64 -42.77 96.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.764 0.283 . . . . 64.13 111.764 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -51.66 -47.44 63.79 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.727 0.299 . . . . 74.14 111.666 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -72.14 -44.23 63.45 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.83 0.348 . . . . 71.41 111.315 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.57 -31.46 69.47 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.003 0.742 . . . . 74.51 113.003 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 79.5 mtp180 -58.88 -28.47 66.17 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.023 0.379 . . . . 74.15 112.023 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -70.41 -13.56 62.19 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.962 0.41 . . . . 73.11 111.391 178.366 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.13 117.72 32.01 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.454 -0.339 . . . . 74.5 110.663 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.49 87.85 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.782 0.66 . . . . 74.55 112.782 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.31 -153.8 6.23 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 115.939 -0.573 . . . . 74.44 112.461 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.3 m -148.09 136.0 21.02 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.758 0.313 . . . . 63.33 111.188 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.1 t -117.42 124.76 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 120.994 0.426 . . . . 75.32 111.545 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.1 t -117.79 153.54 33.27 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.389 -0.369 . . . . 53.53 110.281 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 37.6 p90 -141.8 141.93 33.18 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.61 0.596 . . . . 71.11 112.61 -173.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 17.2 m -119.18 123.36 44.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.091 -0.504 . . . . 72.25 111.14 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.46 121.54 41.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.575 0.226 . . . . 73.23 111.203 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.73 84.53 2.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.093 0.473 . . . . 71.01 111.247 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.53 -91.84 0.04 OUTLIER Glycine 0 CA--C 1.532 1.11 0 CA-C-N 116.226 -0.443 . . . . 45.15 113.56 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 17.7 m-80 -95.91 -15.04 22.66 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 122.548 -0.383 . . . . 74.33 111.609 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.411 ' OD2' ' HD3' ' A' ' 6' ' ' ARG . 4.6 m-20 -97.83 149.41 22.39 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.766 0.654 . . . . 74.5 112.766 -173.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 38.0 tp -138.82 100.7 4.12 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.451 -0.795 . . . . 45.2 110.671 175.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.509 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 38.2 tt0 -89.78 104.37 16.94 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.56 -0.291 . . . . 75.23 111.387 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.75 108.72 24.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.964 0.412 . . . . 60.42 111.08 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 4' ' ' ASP . 94.1 mtt180 -97.82 108.91 21.72 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.743 0.306 . . . . 71.43 111.384 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.6 mt -94.48 121.94 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.76 0.314 . . . . 60.33 110.803 177.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.3 m -119.06 127.97 53.91 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.859 0.318 . . . . 60.2 111.859 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.91 61.79 1.26 Allowed Glycine 0 CA--C 1.527 0.837 0 C-N-CA 121.141 -0.552 . . . . 60.01 113.929 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.81 146.52 61.69 Favored Pre-proline 0 CA--C 1.542 0.669 0 O-C-N 122.504 -0.409 . . . . 60.15 111.554 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.73 137.59 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.514 2.143 . . . . 71.34 112.446 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG3' ' CZ ' ' A' ' 54' ' ' ARG . 36.4 tt0 -55.69 -36.73 67.47 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.879 0.696 . . . . 65.21 112.879 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.06 -30.58 68.17 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.041 0.448 . . . . 75.55 111.529 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.458 HG12 ' HG ' ' A' ' 57' ' ' LEU . 59.7 t -92.66 -32.33 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.515 -0.312 . . . . 73.55 111.281 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.554 ' HD2' HG21 ' A' ' 76' ' ' ILE . 46.4 ttp180 -47.22 -39.5 14.26 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.257 0.551 . . . . 72.42 111.338 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -52.9 -49.06 66.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.55 -0.75 . . . . 62.15 111.432 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.11 -34.87 59.48 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.114 -0.494 . . . . 72.34 111.556 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.458 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.9 mt -61.23 -33.33 73.32 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.027 0.441 . . . . 72.54 111.198 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.54 -39.08 88.4 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.017 0.437 . . . . 63.24 110.845 174.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -70.95 -29.55 65.59 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.35 -0.386 . . . . 72.53 111.638 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 7.1 mm-40 -54.77 -38.21 66.95 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.911 0.386 . . . . 71.21 110.523 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.546 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -58.22 -44.04 87.98 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.129 -0.487 . . . . 75.35 111.053 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.05 -41.46 97.38 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.244 -0.435 . . . . 75.53 111.146 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -63.21 -44.29 95.73 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.202 -0.454 . . . . 71.31 110.867 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 18' ' ' ALA . 96.2 mt -63.05 -37.18 86.18 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.084 -0.507 . . . . 62.54 111.606 178.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.19 77.89 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.197 0.522 . . . . 70.3 110.703 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.84 -25.93 63.97 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.039 -0.528 . . . . 63.31 111.687 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.12 -53.1 62.08 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.125 0.488 . . . . 61.44 111.367 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -110.52 16.64 21.41 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.05 0.389 . . . . 73.24 112.05 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 60.6 23.8 13.55 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.896 0.379 . . . . 74.04 111.917 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.549 HD13 ' HB1' ' A' ' 14' ' ' ALA . 31.2 pt -91.13 179.22 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.219 0.533 . . . . 61.4 111.933 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.5 m -101.33 149.86 23.6 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.208 -0.451 . . . . 71.31 111.223 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.546 HG21 ' HB1' ' A' ' 61' ' ' ALA . 11.2 p -144.92 133.85 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.423 0.63 . . . . 65.33 112.615 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -133.07 128.56 36.48 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.766 -0.652 . . . . 65.05 110.137 173.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -128.22 153.17 47.22 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.645 0.609 . . . . 72.33 112.645 -175.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.3 m -127.49 132.69 49.94 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.846 -0.616 . . . . 44.43 110.737 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.554 HG21 ' HD2' ' A' ' 54' ' ' ARG . 39.5 mt -121.48 110.12 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.167 0.508 . . . . 72.15 111.564 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.3 ptm85 -93.93 144.46 25.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.921 -0.581 . . . . 74.32 111.35 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.484 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.3 pt? -142.83 167.29 22.42 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.149 -0.478 . . . . 71.13 111.034 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.47 135.17 33.57 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.51 -0.552 . . . . 71.32 109.51 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.85 83.53 0.11 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.426 0.631 . . . . 73.12 112.268 -176.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -86.73 160.12 18.93 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.238 -0.437 . . . . 61.45 110.558 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -161.39 142.56 11.36 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.88 0.326 . . . . 74.4 111.88 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -137.17 127.84 27.01 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.742 0.306 . . . . 72.31 111.398 176.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -92.73 159.61 15.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.068 0.461 . . . . 73.31 111.423 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 41.6 m170 . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.824 -0.607 . . . . 72.21 110.56 170.688 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE1' ' HD3' ' A' ' 54' ' ' ARG . 41.0 ttp . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.944 0.402 . . . . 44.22 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.416 ' N ' ' HG2' ' A' ' 1' ' ' MET . 29.9 mt-10 -100.04 147.0 26.09 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.196 -0.456 . . . . 54.44 110.293 173.12 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.469 ' HA ' HG12 ' A' ' 76' ' ' ILE . 21.7 ttt -148.36 108.25 4.03 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.11 0.481 . . . . 62.31 112.076 177.025 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.502 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 8.3 m-20 -92.97 110.15 21.61 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.116 -0.493 . . . . 73.44 110.627 174.034 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -115.6 116.88 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.739 -0.209 . . . . 72.52 110.78 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' ' HA ' ' A' ' 72' ' ' VAL . 1.8 ptp85 -105.76 128.51 53.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.338 0.496 . . . . 60.12 112.338 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -105.06 126.04 51.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.756 -0.656 . . . . 74.34 109.665 172.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -117.03 121.95 42.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.755 0.312 . . . . 73.24 111.238 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.52 157.97 19.58 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 116.043 -0.526 . . . . 65.33 112.346 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -93.46 -10.45 34.98 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.572 0.582 . . . . 70.14 112.572 -177.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.35 109.29 2.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.163 0.506 . . . . 71.32 111.369 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.2 tp -49.19 -55.51 12.24 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.31 0.855 . . . . 62.24 113.31 -174.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.3 69.17 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.311 0.486 . . . . 65.21 112.311 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.65 67.95 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.928 0.394 . . . . 74.22 111.046 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.455 ' CD1' HD22 ' A' ' 42' ' ' LEU . 64.5 t80 -53.6 -52.05 61.07 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.896 -0.593 . . . . 61.5 111.0 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -69.38 -54.21 15.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.761 -0.654 . . . . 70.41 111.983 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -55.91 -46.74 78.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.374 0.509 . . . . 63.13 112.374 -174.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.57 -54.7 11.04 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.887 0.329 . . . . 71.43 111.887 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.6 tp -55.91 -39.27 71.38 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.848 0.356 . . . . 70.14 111.508 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.09 -39.61 95.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.56 -0.291 . . . . 75.31 111.506 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -68.81 -41.56 78.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.725 0.298 . . . . 64.41 111.313 177.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 87.7 mmm -59.99 -47.61 85.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.001 0.429 . . . . 73.13 110.949 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.48 -44.64 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-N 116.203 -0.453 . . . . 63.33 110.978 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -49.62 -50.7 41.9 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.261 0.624 . . . . 74.13 111.964 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.554 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 2.8 mp0 -70.96 -41.21 71.39 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.31 -0.405 . . . . 75.43 111.739 178.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -33.62 74.34 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.34 0.496 . . . . 33.52 112.34 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -28.86 69.54 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.03 0.382 . . . . 62.11 112.03 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HE3' ' HA ' ' A' ' 25' ' ' GLN . 10.4 mtmp? -70.22 -13.94 62.4 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.063 0.458 . . . . 75.13 111.147 175.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -120.28 -172.25 2.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.095 -0.502 . . . . 73.05 110.559 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -94.51 36.2 1.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.172 0.51 . . . . 72.03 110.888 174.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.12 122.71 5.84 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-N 116.232 -0.44 . . . . 73.43 113.867 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.1 m -87.71 118.0 26.92 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.571 -0.37 . . . . 73.44 110.632 175.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.2 t -105.1 137.57 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.247 0.546 . . . . 72.43 112.291 -175.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 t -152.17 167.67 27.79 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.75 -0.659 . . . . 70.14 110.297 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -156.16 158.18 37.21 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.361 0.601 . . . . 75.13 112.345 -175.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 t -132.71 133.64 43.76 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.844 -0.616 . . . . 64.54 110.846 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.23 138.39 34.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.057 0.456 . . . . 73.35 111.814 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -143.44 89.6 2.09 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.223 0.535 . . . . 70.22 110.555 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.74 -99.34 0.47 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.13 -0.486 . . . . 42.21 112.503 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -114.14 12.8 17.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 120.883 0.373 . . . . 73.41 111.243 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -104.26 130.24 52.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.815 0.341 . . . . 55.12 111.26 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.455 HD22 ' CD1' ' A' ' 15' ' ' PHE . 47.8 tp -120.67 96.35 5.09 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.321 -0.4 . . . . 71.14 111.279 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -87.64 109.11 19.43 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.808 0.337 . . . . 70.44 110.832 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.7 mt -101.74 115.21 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 120.83 0.348 . . . . 72.33 111.925 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HD2' ' OG1' ' A' ' 47' ' ' THR . 0.8 OUTLIER -95.45 121.26 36.94 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.189 0.519 . . . . 65.44 111.146 175.938 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.476 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 47.1 mt -121.18 113.59 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.701 173.251 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.536 ' OG1' ' HD2' ' A' ' 45' ' ' ARG . 63.7 m -105.39 133.69 49.73 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.732 0.301 . . . . 55.22 111.365 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.84 -10.69 18.37 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.899 -0.667 . . . . 63.22 113.747 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.461 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 22.5 m -63.49 133.9 95.67 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 116.926 0.363 . . . . 74.43 111.689 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 14.3 Cg_exo -69.34 147.64 66.04 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.757 2.305 . . . . 73.32 113.616 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -46.68 -52.7 13.24 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.814 -0.63 . . . . 64.44 112.46 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -58.94 -29.88 67.45 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.487 0.551 . . . . 74.13 112.487 -177.065 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.541 HG12 ' HG ' ' A' ' 57' ' ' LEU . 42.6 t -79.29 -16.13 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 120.789 0.328 . . . . 52.44 111.652 -176.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB2' ' A' ' 58' ' ' ALA . 46.0 tpt85 -46.63 -37.87 8.82 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.104 0.562 . . . . 75.35 111.917 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -65.91 -54.86 21.04 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.472 -0.785 . . . . 74.5 111.94 -177.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -64.28 -37.18 86.59 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.959 0.355 . . . . 54.52 111.959 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.541 ' HG ' HG12 ' A' ' 53' ' ' VAL . 95.9 mt -60.34 -45.09 94.69 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.865 0.364 . . . . 61.42 111.458 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . . . -63.78 -45.65 88.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.103 0.478 . . . . 63.24 111.462 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -64.29 -31.76 73.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.035 -0.53 . . . . 54.45 111.316 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -72.69 -48.53 38.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.309 -0.405 . . . . 53.44 111.017 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.73 -42.32 71.43 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.22 0.452 . . . . 72.15 112.22 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.23 -48.7 78.14 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.734 0.302 . . . . 72.14 111.47 176.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -63.13 -37.07 85.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.272 -0.422 . . . . 73.4 110.823 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.66 -43.6 96.25 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.99 0.424 . . . . 65.23 111.612 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.06 14.43 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.18 0.437 . . . . 70.01 112.18 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -62.47 -30.7 71.44 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.033 0.382 . . . . 73.1 112.033 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -53.56 -39.5 64.82 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.837 0.351 . . . . 71.21 111.229 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -112.24 12.65 20.37 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 111.855 0.317 . . . . 73.22 111.855 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.3 t30 59.75 23.86 12.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.241 0.543 . . . . 55.52 111.898 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 32.1 pt -93.5 170.16 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.829 -0.544 . . . . 75.34 111.45 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.7 m -94.84 148.26 22.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 116.531 -0.304 . . . . 75.33 111.713 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 13.6 p -146.72 133.25 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 120.996 0.427 . . . . 33.14 111.997 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.6 p -132.67 167.6 19.79 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 122.161 -0.337 . . . . 51.25 110.988 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -125.35 146.23 49.67 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.948 0.404 . . . . 52.22 111.908 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 99.0 m -140.22 122.82 16.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.269 -0.423 . . . . 65.14 110.654 174.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 3' ' ' MET . 66.0 mt -134.2 132.12 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 112.031 0.382 . . . . 51.05 112.031 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.3 mtm180 -83.57 94.51 8.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.839 -0.43 . . . . 75.13 109.839 172.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -109.75 117.7 34.58 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.046 0.45 . . . . 72.0 111.422 -171.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -93.67 130.03 39.76 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.739 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -134.33 134.22 41.56 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.063 0.459 . . . . 64.21 111.334 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -73.44 138.02 44.92 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.149 -0.478 . . . . 71.34 111.593 -176.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -69.98 86.12 0.53 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.554 0.693 . . . . 61.15 110.403 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -75.12 77.77 2.27 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.276 -0.875 . . . . 72.03 112.724 -172.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -171.0 24.36 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.56 -0.745 . . . . 73.13 110.538 173.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.4 m80 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.592 -0.718 . . . . 72.33 111.661 -179.835 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.946 0.403 . . . . 72.32 110.711 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 2.3 tm-20 -137.49 130.99 31.19 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.926 -0.398 . . . . 64.45 109.926 -175.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.546 ' SD ' HG13 ' A' ' 76' ' ' ILE . 12.8 tpt -115.89 120.3 38.77 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.955 1.095 . . . . 74.41 113.955 -161.388 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -97.87 120.67 38.67 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 116.471 -0.331 . . . . 64.43 110.777 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.414 HG13 ' HG3' ' A' ' 3' ' ' MET . 62.7 mt -127.07 140.04 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-O 120.822 0.344 . . . . 64.44 111.028 177.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.42 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 67.0 mtt85 -137.89 121.7 17.6 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.951 -0.468 . . . . 74.1 112.001 -178.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.417 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 75.8 m-85 -100.33 144.9 28.79 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.94 0.4 . . . . 64.42 111.61 178.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 43.7 ttm180 -143.06 131.48 22.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.388 -0.369 . . . . 65.42 110.613 174.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 168.53 -145.94 9.98 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 119.845 -1.169 . . . . 73.21 114.355 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 28.3 t70 -139.36 174.14 10.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 122.528 0.331 . . . . 72.2 111.138 -175.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.434 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 26.8 t70 84.89 137.11 0.05 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 74.13 112.103 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.8 -49.07 61.63 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.013 -0.54 . . . . 73.32 111.743 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.57 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 44.8 mt-10 -59.95 -34.35 73.14 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.609 0.242 . . . . 72.53 111.227 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.75 -44.4 69.93 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.933 0.397 . . . . 72.2 110.734 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.78 -60.28 3.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.213 -0.449 . . . . 74.11 111.912 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 9.3 pt-20 -65.36 -41.86 93.4 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.647 0.61 . . . . 75.41 112.647 -172.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -71.69 -46.58 58.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.219 -0.301 . . . . 73.43 111.6 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -61.17 -48.93 79.28 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.86 0.362 . . . . 73.45 111.027 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 23' ' ' ILE . 59.6 tp -58.33 -44.14 88.53 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.436 -0.347 . . . . 64.45 110.908 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.05 -47.75 80.19 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.476 -0.329 . . . . 71.12 111.68 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 21.9 mm-40 -58.94 -38.7 79.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.821 0.343 . . . . 54.43 111.592 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 86.9 mmm -67.64 -37.94 83.13 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.675 0.274 . . . . 74.02 111.036 176.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 19' ' ' LEU . 76.4 mt -64.7 -40.16 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.1 0.476 . . . . 65.42 110.569 174.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -57.57 -41.7 81.61 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.204 0.526 . . . . 74.1 110.663 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 21' ' ' GLU . 68.2 mt-30 -66.06 -45.16 82.31 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.149 -0.478 . . . . 73.54 110.636 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.44 ' HB2' HG21 ' A' ' 33' ' ' VAL . . . -55.97 -34.42 65.71 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.763 -0.653 . . . . 65.05 112.701 -178.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 10.3 mmm180 -63.13 -29.21 70.62 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.834 0.349 . . . . 71.25 111.422 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -79.81 -18.33 51.18 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.058 0.392 . . . . 55.23 112.058 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -94.38 125.42 39.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.964 0.411 . . . . 52.53 111.704 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.06 59.17 2.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.181 0.515 . . . . 43.15 111.223 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.78 -136.88 2.59 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 115.99 -0.55 . . . . 62.25 113.05 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.1 m -142.68 139.21 31.08 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.919 0.34 . . . . 73.1 111.919 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.555 HG22 HG23 ' A' ' 46' ' ' ILE . 98.3 t -121.65 137.1 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 121.013 0.435 . . . . 70.34 111.608 178.272 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.3 p -117.58 150.84 38.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.052 -0.522 . . . . 63.1 111.003 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.651 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.9 p90 -155.88 131.95 9.99 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.203 0.525 . . . . 64.13 112.383 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 t -137.29 139.62 41.03 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.16 -0.473 . . . . 72.23 111.465 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.1 140.67 29.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.904 0.383 . . . . 64.23 111.788 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -141.81 86.95 2.02 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.157 0.503 . . . . 73.24 110.6 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.98 -94.93 0.15 Allowed Glycine 0 CA--C 1.524 0.649 0 CA-C-N 116.19 -0.459 . . . . 65.54 112.972 -178.153 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -107.68 -7.34 16.45 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.754 0.312 . . . . 74.11 111.116 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -93.71 150.92 20.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.244 0.545 . . . . 71.41 111.812 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' HG13 ' A' ' 44' ' ' ILE . 29.8 tp -138.39 102.21 4.57 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.846 -0.616 . . . . 71.25 110.898 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.651 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 36.3 mm-40 -78.18 111.23 13.9 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.027 -0.533 . . . . 63.51 111.026 178.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.435 HG13 ' HG ' ' A' ' 42' ' ' LEU . 62.8 mt -122.03 109.79 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.053 0.454 . . . . 74.42 111.24 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -112.71 127.16 56.05 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.993 0.425 . . . . 65.03 110.995 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.555 HG23 HG22 ' A' ' 33' ' ' VAL . 54.7 mt -111.34 109.77 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.092 0.473 . . . . 74.53 111.047 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 89.4 m -98.68 109.26 22.04 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.083 -0.508 . . . . 72.55 111.546 -177.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.69 67.23 0.57 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 121.404 -0.427 . . . . 71.12 113.312 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 m -122.13 143.2 38.44 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 112.069 0.396 . . . . 72.31 112.069 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.35 146.25 44.78 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.752 2.302 . . . . 74.14 112.597 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -54.89 -46.92 74.85 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.916 0.389 . . . . 61.13 111.967 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.07 -22.06 60.16 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.463 0.542 . . . . 74.51 112.463 -177.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.47 HG12 ' HG ' ' A' ' 57' ' ' LEU . 48.6 t -85.92 -6.45 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-O 121.085 0.469 . . . . 60.21 111.488 -178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.439 ' HD3' HD12 ' A' ' 76' ' ' ILE . 47.6 tpt85 -50.28 -44.42 53.83 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 111.984 0.365 . . . . 64.44 111.984 176.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -63.5 -40.72 97.82 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.494 -0.321 . . . . 72.43 111.326 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.24 -51.89 61.39 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.358 -0.383 . . . . 73.13 111.169 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.47 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.3 mt -53.16 -49.37 66.78 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.876 0.37 . . . . 74.3 111.811 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.75 -51.12 52.83 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.999 0.428 . . . . 44.04 111.822 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -58.43 -42.63 87.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.955 -0.566 . . . . 72.42 112.257 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.633 ' HG3' HH21 ' A' ' 63' ' ' ARG . 0.4 OUTLIER -70.43 -43.29 70.25 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.235 -0.439 . . . . 73.44 111.783 178.865 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.88 82.69 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.042 0.449 . . . . 74.42 111.314 176.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 45.1 mt-10 -61.66 -43.64 98.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.265 -0.425 . . . . 65.23 111.112 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.633 HH21 ' HG3' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -55.97 -44.16 78.25 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.883 0.373 . . . . 72.23 111.227 176.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 96.2 mt -60.32 -48.87 79.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.0 0.429 . . . . 73.33 111.09 176.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.59 -52.33 65.87 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.151 -0.477 . . . . 72.1 112.023 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.488 ' NZ ' ' HB3' ' A' ' 66' ' ' LYS . 7.7 mtpm? -61.63 -44.67 96.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.28 -0.418 . . . . 74.2 112.033 -177.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.0 -34.2 73.01 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 120.83 0.348 . . . . 51.31 111.898 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.1 7.76 36.37 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.259 0.466 . . . . 73.41 112.259 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 58.68 30.98 20.65 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.468 0.544 . . . . 74.02 112.468 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.6 pt -109.6 177.13 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.009 0.433 . . . . 64.53 111.728 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.433 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 55.4 p -102.62 153.4 20.14 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.119 0.485 . . . . 72.02 111.921 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -152.11 141.56 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.128 0.489 . . . . 74.35 111.628 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 74.4 p -118.55 141.21 48.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.253 -0.43 . . . . 54.43 110.079 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.409 ' HB2' ' HE3' ' A' ' 3' ' ' MET . 21.6 p90 -140.86 120.06 12.93 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.55 -0.296 . . . . 71.43 111.002 -176.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.0 m -153.58 116.71 4.56 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.446 0.535 . . . . 72.34 112.446 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 ' SD ' ' A' ' 3' ' ' MET . 29.1 mt -76.96 141.76 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.491 -0.322 . . . . 71.42 110.408 171.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.03 94.26 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.066 0.936 . . . . 65.43 110.999 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.98 146.94 52.02 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.453 -0.794 . . . . 73.42 112.239 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -95.29 137.12 34.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.106 -0.497 . . . . 75.33 110.956 177.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.1 m-70 -83.35 116.58 22.53 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.735 0.303 . . . . 70.42 110.384 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -68.33 -61.3 1.9 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.546 0.213 . . . . 73.43 111.272 -176.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 82.7 t60 68.64 -22.11 0.14 Allowed 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 114.299 1.222 . . . . 75.51 114.299 168.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -64.09 124.6 22.05 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.858 -0.526 . . . . 71.4 111.571 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -104.48 142.29 34.88 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.258 0.551 . . . . 64.44 112.08 -177.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 70.5 m80 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.828 -0.606 . . . . 74.14 111.015 174.712 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttp . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.475 0.178 . . . . 74.53 110.553 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -124.38 164.08 20.41 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.971 0.415 . . . . 52.05 111.373 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt -148.43 118.84 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.789 0.328 . . . . 61.15 111.828 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 37.0 m-20 -94.81 104.77 16.68 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.779 0.324 . . . . 65.31 111.487 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.1 mt -105.12 146.45 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 122.33 0.252 . . . . 73.42 110.518 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.497 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 5.9 ptm180 -144.16 118.25 9.47 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.509 0.671 . . . . 75.24 111.882 175.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -90.41 149.88 22.08 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.774 -0.648 . . . . 64.32 110.331 174.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -141.74 120.38 12.55 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.701 0.286 . . . . 72.33 110.431 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.12 -164.83 36.21 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 121.065 -0.588 . . . . 53.13 113.143 -177.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -118.37 -24.48 6.85 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.21 0.448 . . . . 73.15 112.21 -176.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.9 118.32 6.55 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.562 . . . . 71.34 112.516 -173.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -67.59 -43.59 80.17 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.067 -0.515 . . . . 71.52 111.741 -178.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 3.5 mp0 -53.97 -30.63 47.78 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.0 0.371 . . . . 62.42 112.0 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.22 -40.36 70.75 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.488 -0.324 . . . . 61.1 111.713 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.474 ' O ' ' HB3' ' A' ' 19' ' ' LEU . 84.3 t80 -53.42 -57.23 11.37 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.306 -0.406 . . . . 71.42 111.429 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -65.38 -57.22 8.88 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.83 0.348 . . . . 74.24 111.625 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 72.8 mmtt -59.77 -47.34 86.07 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.383 0.512 . . . . 74.33 112.383 -170.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.429 ' HB1' HD13 ' A' ' 64' ' ' LEU . . . -75.0 -58.71 3.12 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.547 0.573 . . . . 62.12 112.547 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.474 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 67.7 tp -61.86 -53.29 57.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.194 0.442 . . . . 73.02 112.194 -173.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -60.56 -33.27 72.45 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.15 0.5 . . . . 74.14 110.755 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.503 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 16.1 tp10 -66.78 -44.2 81.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.33 0.652 . . . . 64.12 111.029 176.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.53 -44.61 90.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.994 0.425 . . . . 71.24 111.315 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.554 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.0 mt -61.15 -39.7 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.905 0.383 . . . . 75.55 110.782 175.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 52.3 ttt180 -49.38 -53.84 20.4 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.933 -0.576 . . . . 64.14 111.421 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.495 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 2.8 mp0 -61.04 -42.64 98.86 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.856 0.36 . . . . 64.34 111.273 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.37 -25.33 64.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.059 0.392 . . . . 74.44 112.059 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 3.9 mmp_? -77.96 -30.01 50.12 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.733 0.301 . . . . 74.43 111.529 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 25' ' ' GLN . 54.1 mtmt -75.21 -35.84 61.45 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.015 0.436 . . . . 73.33 110.863 175.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -90.4 -173.38 3.77 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.291 -0.413 . . . . 73.4 110.851 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.38 10.73 38.86 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.058 -0.401 . . . . 65.03 111.848 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -84.33 170.36 46.7 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 121.129 -0.558 . . . . 74.51 113.457 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 85.7 m -134.22 136.22 43.53 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.428 -0.454 . . . . 74.32 111.3 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 95.4 t -109.92 123.92 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.0 0.429 . . . . 73.23 111.973 -178.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 t -117.15 158.93 23.4 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.442 -0.345 . . . . 54.33 110.664 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -155.07 143.8 20.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.928 0.394 . . . . 54.54 112.035 -174.214 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -126.6 129.94 49.53 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.001 0.429 . . . . 65.41 111.419 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.439 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.0 mm? -89.68 133.62 34.56 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.269 -0.423 . . . . 71.34 111.069 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 12.1 t70 -138.3 81.02 1.83 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.349 -0.387 . . . . 72.4 110.488 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.51 -85.79 0.03 OUTLIER Glycine 0 CA--C 1.532 1.103 0 C-N-CA 121.428 -0.415 . . . . 72.14 113.634 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -117.0 9.43 13.68 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.989 0.423 . . . . 71.24 111.504 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 38' ' ' ASP . 5.8 m-20 -112.66 128.75 56.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.295 -0.411 . . . . 74.31 111.553 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.46 95.61 5.04 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.112 0.482 . . . . 75.3 110.331 174.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.497 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 32.4 mt-10 -93.5 112.15 23.98 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.261 0.553 . . . . 74.01 111.576 -176.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.9 mt -109.38 111.73 37.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-N 115.752 -0.658 . . . . 72.51 111.988 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.491 HH12 ' HD2' ' A' ' 77' ' ' ARG . 51.4 ttt85 -101.85 128.18 48.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.903 0.383 . . . . 74.35 111.315 178.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 49.3 mt -111.29 130.73 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 121.128 0.489 . . . . 74.25 111.586 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.7 m -121.08 141.01 51.19 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.246 -0.434 . . . . 63.04 111.533 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.23 46.16 5.09 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 121.247 -0.501 . . . . 51.14 113.59 177.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.8 m -125.31 139.23 33.34 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.539 -0.389 . . . . 70.55 111.539 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.42 168.86 16.13 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.807 2.338 . . . . 73.35 113.033 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.52 -48.63 74.36 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.57 0.581 . . . . 71.3 112.57 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.435 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.8 pt20 -59.72 -42.45 93.14 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.386 0.513 . . . . 71.25 112.386 -176.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 52' ' ' GLN . 90.0 t -76.97 -30.91 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 120.686 0.279 . . . . 74.35 111.496 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.85 -46.0 78.3 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.663 0.268 . . . . 75.32 110.576 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -57.16 -43.25 82.37 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.018 0.437 . . . . 71.21 111.304 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.02 -40.55 96.59 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.076 0.465 . . . . 74.22 111.293 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.91 -41.73 97.6 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.402 -0.363 . . . . 62.02 111.171 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.29 88.41 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.123 0.487 . . . . 71.42 111.217 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -55.61 -38.2 69.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.707 -0.679 . . . . 64.22 111.029 177.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.506 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 8.9 tp10 -70.35 -52.22 24.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.02 -0.536 . . . . 71.33 110.841 176.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.487 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -52.35 -51.44 58.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.765 0.654 . . . . 72.44 112.765 -176.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.47 -37.09 72.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.958 0.408 . . . . 75.43 111.416 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -39.28 68.98 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.344 -0.389 . . . . 62.13 111.394 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 94.4 mt -56.84 -45.51 82.32 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.999 0.428 . . . . 52.52 111.184 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -64.2 -50.71 67.02 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.148 -0.478 . . . . 54.51 111.478 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.55 ' NZ ' ' HB3' ' A' ' 66' ' ' LYS . 3.3 mmmp? -52.14 -44.3 64.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.119 -0.492 . . . . 74.24 112.193 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.15 -24.41 67.15 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.123 0.416 . . . . 75.21 112.123 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -114.86 10.75 16.5 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.761 0.315 . . . . 55.24 111.757 176.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m120 62.03 16.06 7.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.992 0.738 . . . . 64.53 112.992 177.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.434 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 30.4 pt -92.27 165.71 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-O 121.107 0.48 . . . . 73.1 111.953 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.4 m -89.57 148.4 23.39 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.342 -0.39 . . . . 75.44 111.338 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.26 134.49 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.099 0.476 . . . . 52.43 111.745 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.2 p -131.6 155.75 46.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.164 -0.471 . . . . 71.41 110.066 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -146.07 128.87 16.29 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.45 0.643 . . . . 62.14 112.624 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.3 m -100.55 136.13 40.91 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.732 -0.667 . . . . 64.05 110.615 176.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.2 mm -102.21 135.62 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.644 0.259 . . . . 72.05 111.307 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HD2' HH12 ' A' ' 45' ' ' ARG . 7.9 ptp180 -139.71 134.25 31.67 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.304 0.573 . . . . 72.44 111.555 175.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.814 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.3 pt? -104.4 166.14 10.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.822 -0.626 . . . . 75.34 110.482 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.74 118.26 9.34 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.121 0.486 . . . . 65.44 110.346 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -71.46 90.87 1.0 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.44 0.638 . . . . 75.21 111.98 -177.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -114.93 117.54 30.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.999 -0.546 . . . . 64.14 111.226 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 61.17 -96.64 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.916 0.487 . . . . 55.42 112.177 -176.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.0 t60 49.51 95.89 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.659 0.614 . . . . 55.01 112.659 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -136.08 150.48 49.15 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.273 0.558 . . . . 72.34 112.151 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 85.0 t60 . . . . . 0 C--O 1.255 1.345 0 CA-C-N 115.498 -0.773 . . . . 70.31 111.188 176.482 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttp . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.905 0.383 . . . . 73.12 111.427 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.458 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 35.7 mt-10 -84.86 169.55 14.01 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.646 0.26 . . . . 64.25 110.747 174.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.506 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 23.9 ttt -127.41 107.23 9.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.693 0.282 . . . . 65.14 111.585 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.567 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 5.1 m-20 -93.38 128.28 39.36 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.078 -0.51 . . . . 60.32 111.268 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.6 mt -136.57 146.29 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.403 0.281 . . . . 50.01 111.054 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.442 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 98.3 mtt180 -131.69 110.4 10.87 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 122.081 -0.387 . . . . 75.01 111.676 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -89.75 131.93 35.46 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.085 -0.507 . . . . 75.53 110.999 176.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -135.34 129.13 32.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.351 -0.218 . . . . 75.11 110.552 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.85 -158.22 9.56 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 120.462 -0.875 . . . . 43.43 114.394 -176.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.28 13.94 19.21 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.761 0.652 . . . . 53.1 112.761 -175.465 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -143.9 150.28 38.17 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.24 0.543 . . . . 64.11 112.395 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.0 tp -77.02 -57.83 3.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.583 -0.735 . . . . 74.02 111.579 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 33.1 mt-10 -62.9 -27.14 69.16 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.122 0.416 . . . . 71.13 112.122 -176.351 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.7 68.74 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.874 0.369 . . . . 64.33 110.942 174.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.433 ' HB3' HD22 ' A' ' 42' ' ' LEU . 25.1 m-85 -64.02 -41.55 97.41 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.115 0.483 . . . . 72.23 110.821 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.69 -33.16 74.35 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.81 -0.632 . . . . 42.01 111.497 -177.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 11.0 mmpt? -64.37 -52.77 56.62 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.214 0.53 . . . . 75.12 110.246 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.49 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.8 -46.73 86.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.832 -0.622 . . . . 73.33 111.188 177.472 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -55.52 -47.21 76.61 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.844 -0.616 . . . . 64.23 111.436 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -60.53 -43.85 96.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.233 -0.439 . . . . 63.32 111.488 -177.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.56 -42.74 98.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.438 -0.346 . . . . 73.43 111.659 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.439 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 94.8 mmm -62.32 -44.37 96.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.673 -0.239 . . . . 75.3 111.364 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 74.8 mt -64.53 -45.84 94.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 120.784 0.326 . . . . 74.21 111.089 176.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.9 ttp85 -54.29 -43.97 71.53 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.111 0.481 . . . . 53.44 111.332 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -74.07 -39.84 63.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.739 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.46 ' HA ' ' HD2' ' A' ' 29' ' ' PHE . . . -59.76 -29.69 68.34 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.342 0.497 . . . . 60.54 112.342 -177.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.8 mtp180 -56.81 -28.38 61.4 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.11 0.411 . . . . 64.42 112.11 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.2 -26.98 67.64 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 111.958 0.355 . . . . 75.12 111.958 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.46 ' HD2' ' HA ' ' A' ' 26' ' ' ALA . 44.9 m-85 -92.77 142.91 26.82 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 75.04 111.646 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.67 77.5 6.28 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.159 0.504 . . . . 41.24 110.941 176.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -154.47 -155.99 7.5 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 120.886 -0.673 . . . . 41.32 113.934 -177.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -128.57 139.72 52.15 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 122.648 -0.325 . . . . 71.42 111.408 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -114.61 130.29 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.794 0.331 . . . . 75.32 111.303 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 t -145.29 154.24 42.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.798 0.332 . . . . 61.41 111.679 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -156.38 161.79 40.1 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.108 0.48 . . . . 74.51 112.162 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.7 t -137.36 141.89 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.117 -0.492 . . . . 52.42 110.765 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.9 tp -121.39 128.33 52.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.949 0.404 . . . . 75.23 111.832 -176.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -127.63 84.67 2.27 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.144 0.497 . . . . 64.12 110.386 173.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.04 -101.0 0.38 Allowed Glycine 0 CA--C 1.528 0.868 0 CA-C-N 115.66 -0.7 . . . . 64.02 114.258 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -94.89 11.46 31.64 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.786 0.662 . . . . 73.24 112.786 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -145.04 133.38 21.75 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.968 0.413 . . . . 72.33 111.522 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.433 HD22 ' HB3' ' A' ' 15' ' ' PHE . 65.5 tp -122.35 117.39 25.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.399 . . . . 74.45 111.902 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -94.6 118.6 31.95 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.863 0.363 . . . . 71.41 111.253 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 46.5 mt -118.59 126.68 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.735 0.414 . . . . 75.44 110.761 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 3' ' ' MET . 39.9 ttp180 -125.15 121.09 33.19 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.952 0.405 . . . . 74.51 111.566 177.162 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.43 119.56 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.114 0.483 . . . . 73.51 110.843 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.458 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 59.2 m -92.35 112.49 24.46 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.946 -0.57 . . . . 74.01 111.913 -176.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.5 68.96 0.86 Allowed Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.241 -0.504 . . . . 62.21 113.571 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -126.3 130.32 23.96 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 120.799 0.333 . . . . 51.42 111.477 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.49 155.41 31.96 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.041 2.494 . . . . 74.01 114.153 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -66.67 -41.68 87.77 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.823 -0.626 . . . . 71.25 112.437 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.485 ' HG3' HG23 ' A' ' 53' ' ' VAL . 11.4 pt20 -59.23 -26.63 65.04 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.132 0.419 . . . . 70.13 112.132 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.485 HG23 ' HG3' ' A' ' 52' ' ' GLN . 38.3 t -98.4 -5.38 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-O 120.992 0.425 . . . . 70.31 111.642 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.506 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 18.1 tpp180 -53.07 -40.7 64.23 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 122.214 -0.303 . . . . 71.12 111.048 178.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -50.93 -50.78 57.03 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.179 0.514 . . . . 71.41 111.5 177.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -66.73 -54.26 24.7 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.657 -0.701 . . . . 64.21 111.486 -176.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.97 -46.97 81.82 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.052 -0.522 . . . . 71.52 111.905 -178.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.93 76.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.876 0.369 . . . . 65.23 111.606 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -76.19 -36.42 58.65 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.908 0.385 . . . . 72.12 111.323 -179.189 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -63.65 -45.37 90.5 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.921 0.391 . . . . 73.43 111.294 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -60.38 -35.3 75.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.385 -0.37 . . . . 43.42 111.575 177.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 23.0 mm-40 -55.23 -49.29 72.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.845 0.355 . . . . 63.05 110.15 172.144 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 20.9 ttm-85 -56.06 -53.22 59.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.11 -0.495 . . . . 71.31 110.594 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 61' ' ' ALA . 88.5 mt -48.8 -46.85 42.3 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.714 -0.675 . . . . 71.52 112.18 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.18 88.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.31 -0.405 . . . . 73.51 111.781 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 32.2 mmtp -72.36 -35.12 68.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.506 0.558 . . . . 72.43 112.506 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 13.6 mm-40 -54.27 -41.42 68.83 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.051 0.453 . . . . 74.21 111.353 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -103.37 1.43 32.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.335 -0.393 . . . . 71.1 111.498 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.1 m120 54.24 42.32 31.56 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.488 0.661 . . . . 54.11 111.591 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 35.3 pt -103.74 169.3 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.589 -0.732 . . . . 72.05 111.308 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.6 m -87.71 148.97 24.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.64 0.257 . . . . 62.51 111.645 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.27 136.17 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.105 0.479 . . . . 73.41 112.051 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 73.6 p -118.22 146.47 44.22 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.429 -0.351 . . . . 72.2 111.179 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -122.93 137.65 54.89 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.117 0.484 . . . . 75.42 112.225 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 97.6 m -136.34 105.44 5.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.012 -0.54 . . . . 55.24 109.972 173.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.405 ' CD1' ' HG3' ' A' ' 3' ' ' MET . 42.7 mm -101.29 105.48 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 122.26 -0.275 . . . . 64.51 110.987 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 18.3 ptp180 -81.2 100.71 9.25 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.629 0.728 . . . . 65.23 111.249 -178.591 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.1 tt -92.78 126.66 37.97 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.036 -0.529 . . . . 72.43 109.763 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.23 104.36 1.17 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.101 0.477 . . . . 74.33 112.022 -176.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -126.75 110.35 13.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.029 -0.532 . . . . 72.41 110.599 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -140.0 140.45 36.26 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.917 0.389 . . . . 71.22 111.614 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -69.59 -48.11 61.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.263 0.468 . . . . 74.24 112.263 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.9 t-80 64.34 105.49 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.019 0.438 . . . . 70.11 111.935 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -110.3 154.65 23.17 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.497 -0.32 . . . . 64.45 111.154 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 8.2 p80 . . . . . 0 C--O 1.254 1.294 0 CA-C-O 119.491 -0.29 . . . . 71.23 111.429 175.18 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.827 ' SD ' HD13 ' A' ' 78' ' ' LEU . 47.3 ttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.658 0.266 . . . . 74.25 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -117.27 155.74 28.96 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.01 0.374 . . . . 72.41 112.01 -172.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.631 ' HB3' ' NH1' ' A' ' 54' ' ' ARG . 21.8 ptm -149.59 142.36 24.64 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.338 0.495 . . . . 75.04 112.338 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -112.67 118.36 34.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 122.602 0.361 . . . . 72.13 111.518 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.1 mt -115.96 114.54 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 120.612 0.244 . . . . 71.01 110.862 175.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.456 ' HD2' ' N ' ' A' ' 6' ' ' ARG . 3.5 mpt_? -109.02 121.59 45.46 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.938 0.399 . . . . 75.04 111.809 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.571 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 88.4 m-85 -94.34 150.18 20.53 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.258 -0.428 . . . . 73.54 110.922 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 17.2 tpt180 -142.39 120.42 12.1 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.276 -0.42 . . . . 65.12 110.878 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.544 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -178.59 -179.35 48.41 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.978 -0.63 . . . . 71.13 113.108 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -108.49 -17.47 13.97 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.517 0.562 . . . . 61.33 112.517 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.38 110.18 7.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.027 0.441 . . . . 71.01 110.898 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 50.6 tp -62.38 -41.73 98.86 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.232 0.456 . . . . 65.31 112.232 -175.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -66.37 -35.03 79.31 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.577 0.227 . . . . 61.1 111.51 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.6 70.86 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.464 -0.334 . . . . 73.23 111.691 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -56.18 -51.77 66.82 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.651 -0.249 . . . . 74.33 111.403 177.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.26 -45.24 85.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.736 0.303 . . . . 71.45 111.439 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -57.83 -38.77 76.19 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.805 0.336 . . . . 72.12 111.804 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.551 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -73.96 -53.14 10.75 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.407 0.623 . . . . 73.24 111.234 177.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -60.07 -46.1 90.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.628 -0.715 . . . . 65.14 112.525 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -58.6 -40.0 81.99 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.776 0.43 . . . . 75.32 111.646 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -73.58 -38.83 65.04 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.889 0.376 . . . . 75.03 111.198 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 97.1 mmm -58.27 -46.58 85.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.066 0.46 . . . . 74.25 110.452 174.174 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 69.0 mt -64.63 -39.36 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.048 -0.524 . . . . 65.33 111.004 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 8.9 tpt180 -53.62 -50.11 66.39 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.855 0.36 . . . . 74.15 111.044 177.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -67.1 -48.78 67.12 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.397 -0.365 . . . . 61.21 111.13 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.84 -34.08 67.42 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.685 0.624 . . . . 71.13 112.685 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -59.21 -27.74 66.0 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.024 0.379 . . . . 75.41 112.024 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -76.62 -18.26 58.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.816 0.341 . . . . 62.15 111.875 178.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -108.33 143.79 36.74 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.079 0.466 . . . . 74.4 111.679 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.3 89.6 5.52 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.077 0.465 . . . . 71.32 111.759 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -155.97 -155.53 7.42 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.246 -0.502 . . . . 73.12 112.975 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.3 m -137.73 131.29 31.1 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.519 -0.401 . . . . 63.12 111.258 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.437 HG22 HG23 ' A' ' 46' ' ' ILE . 88.8 t -124.81 118.62 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.844 0.355 . . . . 74.34 111.264 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 45' ' ' ARG . 30.3 p -107.41 129.76 54.89 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.531 -0.304 . . . . 71.22 111.007 179.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 52.7 p90 -133.0 142.74 49.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.349 0.5 . . . . 64.12 112.349 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 64.8 p -133.21 137.99 46.35 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.124 -0.489 . . . . 73.13 111.456 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.24 134.46 53.76 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.252 -0.431 . . . . 74.21 110.935 177.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -149.95 95.93 2.37 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.955 0.407 . . . . 42.51 111.396 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.66 -82.26 0.05 OUTLIER Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.263 -0.494 . . . . 75.34 113.532 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 78.9 m-20 -122.47 -3.65 8.85 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 122.489 -0.419 . . . . 75.01 112.014 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -101.95 134.99 44.29 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.992 0.425 . . . . 70.43 111.822 -177.399 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 22.9 tp -128.91 99.96 5.49 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.022 -0.536 . . . . 74.25 110.366 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 46.0 mt-10 -91.92 104.48 16.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 75.41 111.326 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.6 mt -102.14 128.8 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.223 -0.444 . . . . 65.35 110.409 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB3' ' OG1' ' A' ' 34' ' ' THR . 51.1 ttt180 -126.16 112.57 15.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.93 0.395 . . . . 72.14 110.475 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.437 HG23 HG22 ' A' ' 33' ' ' VAL . 52.7 mt -104.85 114.47 44.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-O 121.246 0.546 . . . . 73.2 111.531 -176.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.6 m -105.14 113.82 27.65 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.848 -0.615 . . . . 63.51 111.769 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.3 -43.54 1.28 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 120.599 -0.81 . . . . 62.1 114.515 174.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.57 HG23 HH21 ' A' ' 54' ' ' ARG . 17.6 m -50.7 128.8 26.89 Favored Pre-proline 0 N--CA 1.478 0.969 0 N-CA-C 113.833 1.049 . . . . 65.25 113.833 -172.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -85.42 -169.26 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.772 2.981 . . . . 75.02 114.277 -177.059 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -48.45 -72.02 0.06 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.582 0.956 . . . . 75.24 113.582 -176.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.472 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 24.2 pt20 -50.11 -34.41 21.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.754 0.65 . . . . 64.35 112.754 -174.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 t -80.23 -36.02 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 120.989 0.423 . . . . 60.55 111.447 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB3' ' A' ' 3' ' ' MET . 4.5 tpp180 -53.77 -52.78 59.11 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.85 -0.614 . . . . 74.21 112.016 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . 0.472 ' HE3' ' HA ' ' A' ' 52' ' ' GLN . 22.2 pttp -61.67 -34.68 76.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.091 -0.504 . . . . 54.44 111.951 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -71.53 -42.51 67.85 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.66 0.267 . . . . 74.15 111.617 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.436 HD11 HG11 ' A' ' 49' ' ' VAL . 86.6 mt -64.45 -45.35 87.84 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.945 0.402 . . . . 73.52 111.183 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.29 96.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.171 0.51 . . . . 71.3 111.203 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -63.77 -35.43 80.58 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.043 -0.526 . . . . 73.31 111.593 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -67.12 -42.56 84.3 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.915 0.388 . . . . 71.35 110.998 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.558 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -52.17 -40.84 62.02 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.082 -0.508 . . . . 65.4 112.058 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 35.0 mm-40 -61.74 -50.55 71.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.727 0.298 . . . . 72.15 111.682 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -55.45 -51.7 66.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.94 0.4 . . . . 74.05 111.101 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.551 HD22 ' HA ' ' A' ' 18' ' ' ALA . 83.4 mt -55.39 -41.28 72.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.745 -0.661 . . . . 32.11 111.465 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.533 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -64.68 -50.96 64.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.178 0.513 . . . . 34.5 112.256 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 10.5 mmpt? -63.19 -60.54 3.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.096 0.776 . . . . 61.34 113.096 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -75.44 -15.77 60.4 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.962 0.727 . . . . 72.15 112.962 -172.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' A' ' 64' ' ' LEU . 84.9 m-85 -100.6 8.57 43.34 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 122.079 -0.388 . . . . 72.31 111.973 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 60.46 35.75 20.28 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.584 0.587 . . . . 75.33 112.584 173.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.544 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.6 pt -126.06 149.38 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 121.184 0.516 . . . . 64.33 111.639 179.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.7 m -86.97 139.59 30.44 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.403 -0.362 . . . . 62.23 110.735 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.558 HG21 ' HB1' ' A' ' 61' ' ' ALA . 14.5 p -126.22 122.1 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.547 0.689 . . . . 63.42 112.414 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 80.9 p -121.18 121.7 38.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.788 -0.642 . . . . 73.11 110.449 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -122.05 143.09 49.71 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.869 0.692 . . . . 75.44 112.869 -175.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 94.4 m -122.54 120.26 33.29 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.567 -0.742 . . . . 75.05 110.612 178.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -118.79 144.86 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.959 0.409 . . . . 70.3 111.451 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 77' ' ' ARG . 59.3 mmt-85 -123.68 110.47 15.01 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.023 0.44 . . . . 74.32 111.513 175.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.827 HD13 ' SD ' ' A' ' 1' ' ' MET . 33.3 tp -117.23 112.9 21.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.248 -0.433 . . . . 71.23 110.774 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -67.82 95.56 0.52 Allowed 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.232 0.539 . . . . 74.12 110.81 178.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.6 p-80 -118.2 128.42 54.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.076 -0.511 . . . . 70.33 111.3 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -79.18 142.34 36.41 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.128 -0.487 . . . . 71.05 111.428 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -63.74 113.14 3.19 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.956 0.408 . . . . 62.34 110.523 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -67.5 -38.79 84.86 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.689 0.626 . . . . 74.41 112.689 -170.795 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -123.33 163.78 20.09 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.925 0.393 . . . . 72.14 111.822 -179.114 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 . . . . . 0 C--O 1.254 1.307 0 CA-C-O 118.79 -0.624 . . . . 72.52 111.733 176.944 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.643 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 49.4 ttp . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.044 0.45 . . . . 70.11 111.51 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.664 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 27.3 mt-10 -127.42 170.8 12.15 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.115 -0.493 . . . . 73.1 110.774 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.658 ' SD ' ' NH2' ' A' ' 54' ' ' ARG . 27.5 ttt -143.69 128.0 17.78 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.649 0.611 . . . . 65.21 112.649 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 6' ' ' ARG . 4.7 m-20 -82.72 128.86 34.77 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.665 -0.698 . . . . 54.35 110.222 171.729 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.7 mt -139.56 109.42 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.77 0.319 . . . . 74.55 111.146 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 43' ' ' GLU . 2.4 mpt_? -119.45 125.41 48.87 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 122.104 -0.373 . . . . 65.13 111.975 -179.339 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -109.11 145.56 35.49 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 116.26 -0.427 . . . . 73.0 111.498 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -142.5 120.09 11.77 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.316 -0.253 . . . . 73.5 110.316 172.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -148.73 159.68 28.12 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.649 -0.786 . . . . 52.4 113.693 -176.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.98 -13.02 34.17 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.148 0.425 . . . . 73.53 112.148 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.27 161.08 25.3 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.039 0.447 . . . . 65.31 111.933 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.3 tp -85.51 -58.51 2.64 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.948 0.404 . . . . 75.24 111.674 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 41.4 mt-10 -66.78 -30.25 70.41 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 111.979 0.363 . . . . 62.31 111.979 -175.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.2 -33.17 51.64 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.997 0.369 . . . . 64.01 111.997 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.425 ' CE1' HD11 ' A' ' 37' ' ' LEU . 77.4 t80 -59.68 -53.56 56.64 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.109 0.481 . . . . 72.43 111.213 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -73.78 -36.9 65.11 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.016 -0.538 . . . . 74.4 111.906 -176.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 75.2 mmtt -59.59 -54.21 49.12 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.948 0.404 . . . . 63.34 111.306 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.48 -47.76 84.74 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.255 -0.43 . . . . 70.44 111.724 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.32 -45.44 91.32 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.026 0.441 . . . . 64.21 111.55 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -64.07 -42.91 96.83 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.303 -0.408 . . . . 62.33 111.653 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -61.8 -46.51 89.23 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.103 0.408 . . . . 73.53 112.103 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 78.2 mmm -56.52 -44.8 81.14 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.845 0.355 . . . . 75.54 111.196 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.9 mt -66.13 -43.43 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 121.054 0.454 . . . . 71.53 110.936 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -53.02 -54.68 31.77 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.229 0.612 . . . . 73.33 112.017 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.07 -37.75 84.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.774 0.321 . . . . 73.01 111.512 176.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.24 -25.24 65.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.222 0.452 . . . . 71.41 112.222 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 11.8 mmm180 -56.59 -27.79 58.8 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.142 0.423 . . . . 65.14 112.142 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.429 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -61.96 -25.56 67.68 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 111.788 0.292 . . . . 72.13 111.788 178.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.444 ' CZ ' HG21 ' A' ' 53' ' ' VAL . 23.4 m-85 -118.06 171.73 7.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.449 0.642 . . . . 72.3 112.074 -173.761 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.16 90.52 3.96 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.047 -0.524 . . . . 75.03 110.574 173.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -152.17 164.7 30.58 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 120.975 -0.631 . . . . 52.0 113.355 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -95.95 123.26 39.47 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.777 0.322 . . . . 73.53 111.594 -177.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t -115.31 119.35 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 116.255 -0.429 . . . . 71.4 110.552 175.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -130.87 164.48 25.14 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.701 0.286 . . . . 64.54 111.426 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.9 p90 -155.23 146.97 23.25 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.007 0.432 . . . . 73.55 111.683 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.557 HG23 ' HB3' ' A' ' 43' ' ' GLU . 0.7 OUTLIER -137.32 137.38 38.88 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.886 0.374 . . . . 74.14 111.406 178.395 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.425 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.4 130.47 34.64 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.914 0.388 . . . . 60.42 111.568 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.58 106.32 7.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.992 0.425 . . . . 75.15 110.878 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.47 -97.0 0.22 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 121.229 -0.51 . . . . 54.33 113.335 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -125.29 11.14 8.08 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.132 0.419 . . . . 63.4 112.132 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -132.67 158.96 40.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.353 0.597 . . . . 64.15 112.407 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 35' ' ' TYR . 64.0 tp -109.08 125.29 51.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.778 -0.647 . . . . 74.14 111.604 -177.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.696 ' HA ' ' HG3' ' A' ' 6' ' ' ARG . 1.5 tm-20 -101.87 108.37 19.82 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.269 -0.423 . . . . 71.34 110.471 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -108.6 139.78 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.08 0.466 . . . . 73.23 112.245 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -125.28 123.28 39.13 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.072 -0.513 . . . . 74.44 110.763 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.59 121.83 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.819 0.343 . . . . 73.44 111.45 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.531 HG23 ' HG2' ' A' ' 2' ' ' GLU . 86.2 m -121.86 126.74 49.41 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.28 -0.418 . . . . 74.2 111.601 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.15 55.32 0.51 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.238 -0.506 . . . . 52.02 113.941 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 24.7 m -133.58 144.37 51.82 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.356 -0.497 . . . . 74.25 111.783 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.83 162.83 10.53 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.909 2.406 . . . . 72.4 113.598 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.55 -37.06 84.64 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.361 0.504 . . . . 74.41 112.361 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -60.3 -18.53 50.07 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.736 0.643 . . . . 74.12 112.736 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.54 HG12 ' HG ' ' A' ' 57' ' ' LEU . 16.4 t -112.42 -2.68 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.397 0.617 . . . . 62.33 111.066 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.658 ' NH2' ' SD ' ' A' ' 3' ' ' MET . 5.3 tpm_? -52.59 -58.38 6.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.87 -0.604 . . . . 65.54 112.525 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -66.05 -33.34 75.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.036 -0.529 . . . . 74.15 111.625 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.85 -50.56 70.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.21 -0.45 . . . . 72.43 111.235 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HG ' HG12 ' A' ' 53' ' ' VAL . 98.7 mt -61.36 -38.48 87.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.931 0.396 . . . . 61.53 111.206 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.26 98.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.219 -0.446 . . . . 74.44 111.678 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 62' ' ' GLU . 22.0 ttmm -78.51 -32.73 48.26 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 120.903 0.383 . . . . 53.33 111.954 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ARG . 29.1 tt0 -64.16 -32.87 74.61 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.952 -0.467 . . . . 72.11 110.555 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.4 -38.41 74.25 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.372 -0.377 . . . . 73.15 110.845 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 43.5 mt-10 -59.64 -43.72 93.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.979 0.419 . . . . 72.13 110.574 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 33.8 ttm180 -54.95 -54.0 48.38 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.28 -0.418 . . . . 71.14 111.347 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 18' ' ' ALA . 93.5 mt -56.42 -39.19 72.65 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 75.32 111.687 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.14 -57.13 4.51 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.069 0.461 . . . . 73.23 111.938 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.82 -24.86 66.22 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.52 . . . . 74.23 112.403 -174.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -61.18 -47.92 83.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.116 0.484 . . . . 72.45 110.587 179.211 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -104.27 8.68 36.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.152 -0.476 . . . . 62.21 111.396 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 60.96 24.92 14.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.494 0.553 . . . . 74.02 112.494 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.2 pt -87.77 166.43 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.006 0.431 . . . . 75.51 111.673 -177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.2 m -87.54 142.5 27.8 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.48 -0.327 . . . . 72.3 111.366 -178.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 14.6 p -143.62 134.97 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.135 0.493 . . . . 62.52 111.839 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -119.43 123.09 43.22 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.697 -0.483 . . . . 74.54 109.697 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 34.0 p90 -128.46 135.32 49.3 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.232 0.539 . . . . 65.51 111.829 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.405 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 86.6 m -133.39 148.55 51.82 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.888 -0.596 . . . . 61.24 110.781 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.9 mm -101.99 114.28 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.907 0.384 . . . . 74.12 111.196 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 13.7 mtp180 -84.58 106.61 16.28 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.177 0.436 . . . . 74.11 112.177 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.404 HD22 ' N ' ' A' ' 78' ' ' LEU . 3.0 mm? -103.3 158.91 16.0 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.018 -0.537 . . . . 74.45 110.049 170.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -72.57 139.91 47.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.519 -0.31 . . . . 71.25 110.897 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -75.22 67.92 1.9 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 122.075 0.94 . . . . 54.2 109.112 172.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -65.96 133.31 50.59 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 114.711 -1.131 . . . . 62.3 111.633 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -72.24 102.23 3.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.038 -0.528 . . . . 73.22 110.515 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -152.29 139.26 19.07 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.209 -0.45 . . . . 74.41 111.551 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -124.89 177.71 5.88 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.115 -0.493 . . . . 73.01 110.35 177.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 . . . . . 0 C--O 1.248 1.026 0 O-C-N 122.361 -0.212 . . . . 75.32 111.407 177.352 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 tmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.806 -0.442 . . . . 73.13 109.806 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -102.58 148.72 25.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.926 0.394 . . . . 73.32 111.469 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.7 ttt -124.36 124.44 42.37 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.146 0.498 . . . . 61.11 112.123 -176.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -106.12 115.34 30.06 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.967 -0.56 . . . . 64.24 110.798 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.2 mt -120.72 141.69 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.42 0.288 . . . . 63.41 111.089 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.473 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 26.4 mtm105 -144.37 122.63 12.26 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.153 0.427 . . . . 70.31 112.153 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 41' ' ' ASP . 95.8 m-85 -103.13 125.43 49.83 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.473 -0.33 . . . . 70.4 111.628 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.509 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 8.2 tpt180 -104.33 119.33 38.73 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.813 0.34 . . . . 75.24 110.616 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.43 146.63 9.64 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 121.235 -0.507 . . . . 74.43 113.029 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -94.28 3.07 55.73 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 122.461 -0.434 . . . . 62.22 112.111 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.08 134.27 37.75 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.089 0.471 . . . . 71.42 111.991 177.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -71.3 -52.76 17.07 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.218 -0.446 . . . . 44.3 111.606 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.29 -31.2 67.26 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.783 0.325 . . . . 65.21 111.792 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.97 -40.14 69.73 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.518 -0.31 . . . . 73.44 111.69 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -56.64 -54.26 48.1 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.904 0.383 . . . . 64.44 111.333 176.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.02 -49.95 70.38 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.355 -0.384 . . . . 71.44 111.765 -178.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 70.3 mmtt -61.87 -54.57 40.29 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.331 0.493 . . . . 75.53 112.331 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.494 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -57.71 -48.55 79.24 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.82 0.343 . . . . 64.51 111.879 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.72 -44.68 92.87 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.856 0.36 . . . . 64.12 111.333 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -62.49 -46.01 90.39 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.966 0.358 . . . . 71.12 111.966 -177.236 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 25.7 mm-40 -64.82 -45.54 85.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.634 0.254 . . . . 75.14 111.557 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.6 mmt -55.8 -50.64 69.94 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.125 0.488 . . . . 72.53 111.017 176.671 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.559 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 64.9 mt -62.18 -42.47 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.269 -0.423 . . . . 73.45 111.429 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.7 ttm-85 -49.28 -48.12 46.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.108 0.48 . . . . 62.11 111.474 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -68.43 -46.08 70.84 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.939 -0.573 . . . . 75.42 111.829 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.37 -22.39 63.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.225 0.824 . . . . 52.32 113.225 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 37.1 mtp85 -56.68 -28.66 61.21 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 112.777 0.658 . . . . 65.15 112.777 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.4 OUTLIER -74.78 -20.95 59.58 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.969 0.359 . . . . 63.24 111.969 179.235 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -106.73 178.0 4.69 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.393 0.616 . . . . 62.13 112.181 -173.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -89.94 28.07 1.45 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.953 -0.567 . . . . 24.13 111.269 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.16 128.87 9.63 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 116.074 -0.512 . . . . 74.3 113.182 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 96.2 m -88.49 117.37 27.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.883 0.373 . . . . 73.43 111.026 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.495 HG22 HG12 ' A' ' 46' ' ' ILE . 77.1 t -103.41 109.79 28.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 120.996 0.427 . . . . 72.42 111.225 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.4 t -110.86 157.06 20.26 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.361 -0.381 . . . . 71.32 110.894 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.431 ' HB2' HD11 ' A' ' 42' ' ' LEU . 29.3 p90 -140.96 133.87 29.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.128 0.489 . . . . 75.12 112.1 -176.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 p -129.61 130.54 45.78 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.078 -0.51 . . . . 72.42 110.528 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -91.36 120.35 32.15 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.946 0.35 . . . . 52.54 111.946 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -113.25 88.97 2.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.941 0.4 . . . . 71.43 109.973 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.68 -101.2 0.23 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.167 -0.54 . . . . 70.32 113.558 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 36.7 m-80 -109.03 13.21 24.76 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.584 -0.363 . . . . 62.21 111.669 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.465 ' HA ' ' O ' ' A' ' 7' ' ' PHE . 21.8 t70 -119.47 121.85 40.38 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.134 0.492 . . . . 74.42 110.654 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 35' ' ' TYR . 41.5 tp -94.47 106.84 18.83 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.194 -0.457 . . . . 73.21 110.897 178.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 6' ' ' ARG . 36.2 mt-10 -85.06 103.85 14.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.97 0.414 . . . . 70.3 111.068 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 113.2 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 120.984 0.421 . . . . 75.24 111.066 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -109.06 120.82 43.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.813 0.339 . . . . 64.42 111.154 -178.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.495 HG12 HG22 ' A' ' 33' ' ' VAL . 53.4 mt -110.99 112.39 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 120.942 0.401 . . . . 74.43 111.214 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 73.0 m -107.01 132.49 52.88 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.186 0.439 . . . . 71.23 112.186 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.86 62.02 1.88 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.409 -0.424 . . . . 74.5 114.152 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 m -133.01 139.03 33.16 Favored Pre-proline 0 CA--C 1.545 0.773 0 O-C-N 122.481 -0.423 . . . . 52.41 111.944 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -58.05 132.61 50.44 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.738 2.292 . . . . 74.33 113.081 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -52.11 -36.4 50.94 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.076 0.769 . . . . 53.12 113.076 -174.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -67.2 -34.76 78.19 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 120.803 0.335 . . . . 73.45 111.871 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.2 t -75.21 -19.19 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 121.105 0.478 . . . . 62.4 111.185 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -50.6 -36.47 35.13 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.044 -0.526 . . . . 74.44 111.971 177.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -61.91 -43.08 99.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.702 -0.226 . . . . 73.33 111.496 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -64.61 -43.35 94.05 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.802 0.334 . . . . 72.34 111.121 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.8 -42.61 99.23 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.02 0.438 . . . . 74.42 111.05 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -67.87 -45.33 74.82 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 65.32 111.591 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -65.95 -32.82 74.53 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 75.13 111.427 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.59 -45.46 93.88 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.641 -0.503 . . . . 74.13 109.641 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.75 97.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.137 -0.483 . . . . 52.24 111.541 176.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-10 -55.54 -45.51 77.19 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.279 0.561 . . . . 74.01 110.533 175.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 63' ' ' ARG . 9.8 tpt180 -64.98 -49.51 69.99 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.584 -0.735 . . . . 74.21 111.412 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.494 HD22 ' HA ' ' A' ' 18' ' ' ALA . 91.8 mt -54.43 -45.2 72.97 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.029 0.381 . . . . 73.52 112.029 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.27 -56.72 15.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.807 0.337 . . . . 74.52 111.724 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -61.85 -35.75 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.147 0.425 . . . . 75.32 112.147 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.74 -34.94 73.61 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.03 0.443 . . . . 71.42 111.243 -178.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -105.71 0.04 25.9 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.349 -0.387 . . . . 72.31 111.553 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 61.17 21.62 12.04 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.113 0.565 . . . . 71.43 112.078 -177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 33.2 pt -86.92 175.34 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.015 0.436 . . . . 65.22 111.239 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 22.8 m -93.54 146.42 23.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.738 0.304 . . . . 73.11 111.318 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.2 p -137.6 139.57 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.148 0.499 . . . . 33.13 111.518 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.9 p -132.49 143.13 49.55 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.086 -0.507 . . . . 72.32 110.097 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -147.57 134.13 19.82 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.213 0.53 . . . . 74.12 111.916 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.3 p -121.08 145.0 48.25 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.957 -0.565 . . . . 71.34 110.822 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.7 mm -117.26 144.78 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.626 -0.261 . . . . 75.54 110.945 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -143.39 141.36 30.86 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.234 0.54 . . . . 73.22 111.66 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.4 tp -104.67 120.45 41.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.974 -0.557 . . . . 71.45 110.061 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.59 94.03 0.08 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.978 0.418 . . . . 72.32 111.393 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -154.37 120.39 5.29 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.356 -0.384 . . . . 74.14 110.946 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -79.55 99.64 7.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.097 0.475 . . . . 64.24 111.503 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -68.98 92.01 0.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.32 -0.4 . . . . 61.25 111.134 177.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.2 p-80 -73.09 128.58 35.89 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.86 0.362 . . . . 72.32 111.318 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -88.92 136.53 32.96 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.913 0.387 . . . . 73.52 111.866 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.826 -0.607 . . . . 74.42 111.169 175.964 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.0 mtp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.14 0.495 . . . . 74.53 111.558 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -133.43 147.4 51.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.005 -0.543 . . . . 72.14 109.586 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.457 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 28.6 ttt -148.88 118.99 7.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.092 0.775 . . . . 72.4 113.092 -173.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 6.5 m-20 -87.97 119.39 28.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.445 -0.343 . . . . 62.11 110.38 172.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 51.2 mt -116.33 108.4 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.032 0.444 . . . . 71.21 111.064 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.426 ' HG2' ' HB2' ' A' ' 43' ' ' GLU . 61.8 mtm-85 -98.56 102.1 13.74 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.575 0.583 . . . . 74.2 112.575 -176.225 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -85.78 143.24 28.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.454 -0.339 . . . . 73.23 110.305 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 43.9 ttt180 -141.47 118.88 11.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.564 0.221 . . . . 73.33 110.599 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.96 153.19 24.65 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.194 -0.527 . . . . 63.11 113.136 -176.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -97.49 -14.27 21.22 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.045 0.757 . . . . 64.23 113.045 -174.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' CG ' ' H ' ' A' ' 12' ' ' LEU . 7.2 p-10 -72.66 -91.13 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 112.87 0.693 . . . . 75.31 112.87 -174.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.444 ' H ' ' CG ' ' A' ' 11' ' ' ASP . 57.9 tp 171.14 -51.82 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.145 0.578 . . . . 74.55 110.04 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 48.7 mt-10 -62.39 -29.93 70.84 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.652 -0.704 . . . . 54.04 111.687 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.71 -39.67 62.27 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.817 0.342 . . . . 75.32 111.383 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -62.47 -60.53 3.42 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.928 0.394 . . . . 61.41 111.574 176.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -63.12 -50.51 70.2 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.499 0.555 . . . . 71.33 112.499 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 65.0 mmtt -67.02 -46.1 75.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 111.742 0.275 . . . . 74.31 111.742 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -63.96 -46.21 85.7 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.781 0.324 . . . . 74.12 111.369 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.03 -47.23 78.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.017 0.437 . . . . 64.34 110.566 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -52.07 -55.92 17.66 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.704 -0.68 . . . . 74.13 112.166 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.89 -42.5 97.44 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.157 0.429 . . . . 73.21 112.157 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.429 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 77.6 mmm -61.94 -45.16 94.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.636 0.255 . . . . 74.42 111.294 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 66.7 mt -60.36 -40.45 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.733 0.302 . . . . 75.3 110.634 175.283 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -56.6 -41.98 77.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.866 0.365 . . . . 73.42 111.041 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -69.28 -42.87 74.94 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.059 0.457 . . . . 72.45 111.183 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.82 -35.52 81.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.377 -0.374 . . . . 63.15 111.816 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 41.4 mtp85 -64.36 -28.88 70.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.189 0.44 . . . . 73.45 112.189 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -55.32 -43.39 74.87 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.285 0.564 . . . . 73.43 110.491 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -97.84 -6.15 33.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.773 -0.649 . . . . 74.22 111.838 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 60.17 42.83 14.84 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.053 0.454 . . . . 42.34 111.922 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -87.57 -175.96 48.45 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.268 -0.491 . . . . 72.34 113.784 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.6 m -94.76 131.45 40.58 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.649 0.38 . . . . 74.31 111.315 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.34 125.56 70.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 112.165 0.431 . . . . 62.31 112.165 -178.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -136.26 144.83 45.01 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.217 -0.447 . . . . 72.12 110.773 173.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 44.3 p90 -142.84 140.68 31.38 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.566 0.58 . . . . 73.11 112.566 -176.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 p -115.24 141.83 47.49 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 116.01 -0.541 . . . . 71.34 111.696 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -113.36 125.73 54.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.031 0.443 . . . . 74.43 112.067 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.47 96.35 2.97 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.29 -0.414 . . . . 73.21 110.346 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.89 -101.12 0.62 Allowed Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.993 -0.622 . . . . 61.22 112.862 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -110.04 3.93 20.81 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.973 0.416 . . . . 70.43 110.992 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -93.8 130.74 39.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.097 -0.502 . . . . 73.11 112.044 -175.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.1 tp -131.68 101.55 5.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.097 -0.502 . . . . 74.41 110.955 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.5 tt0 -97.27 108.77 21.57 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.884 0.374 . . . . 75.01 111.116 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.8 mt -101.95 108.57 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.226 -0.443 . . . . 65.42 110.867 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -93.11 111.3 22.89 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.878 0.371 . . . . 61.42 110.684 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.7 mt -101.98 110.41 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.312 0.577 . . . . 65.24 110.734 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -97.84 130.44 44.75 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 72.24 111.154 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.05 -15.88 15.82 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 120.95 -0.643 . . . . 52.32 113.558 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.928 HG23 HH22 ' A' ' 54' ' ' ARG . 15.1 m -61.2 138.64 94.5 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-N 117.221 0.511 . . . . 73.11 112.086 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.62 -176.87 3.2 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.191 2.594 . . . . 61.24 114.286 -173.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 10.2 pt-20 -90.49 -50.48 5.92 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.581 0.585 . . . . 64.3 112.581 -176.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -64.11 -40.5 96.33 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.649 0.611 . . . . 70.44 112.649 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.415 ' O ' HG12 ' A' ' 53' ' ' VAL . 22.8 t -73.58 -3.33 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 CA-C-O 120.955 0.407 . . . . 75.3 111.847 -177.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.928 HH22 HG23 ' A' ' 49' ' ' VAL . 18.4 tpp180 -51.22 -35.39 36.53 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.127 0.417 . . . . 72.32 112.127 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -55.76 -53.59 54.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.255 0.55 . . . . 75.42 111.378 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -74.54 -32.86 62.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.158 -0.474 . . . . 70.42 111.864 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.3 mt -56.75 -43.66 80.97 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.114 0.483 . . . . 53.33 111.065 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.07 73.29 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.026 0.441 . . . . 74.11 111.109 175.052 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -56.52 -39.61 73.64 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.961 -0.563 . . . . 75.33 111.94 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -64.81 -48.22 75.19 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.908 0.385 . . . . 44.32 110.904 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.28 -43.9 88.21 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.155 -0.475 . . . . 61.25 111.264 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 49.5 mt-10 -60.96 -42.14 97.72 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.309 -0.405 . . . . 71.44 111.168 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 27.9 ttm180 -55.26 -54.9 37.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.69 0.281 . . . . 75.44 110.653 174.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.5 mt -52.63 -45.9 66.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.17 -0.468 . . . . 71.42 111.675 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.67 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.402 -0.363 . . . . 72.5 111.85 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 34.0 mmtp -72.3 -30.23 64.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.178 0.436 . . . . 65.15 112.178 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.7 mm-40 -61.9 -38.51 88.62 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 122.118 -0.364 . . . . 73.43 111.598 178.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -100.87 -5.89 25.48 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.862 0.319 . . . . 62.53 111.862 178.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 56.2 t30 56.64 60.03 3.28 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.643 0.735 . . . . 75.4 110.551 -173.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 39.6 pt -125.39 -176.37 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 115.502 -0.772 . . . . 71.41 111.28 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.5 m -98.89 141.42 31.69 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.596 -0.275 . . . . 44.11 111.712 -177.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.1 p -142.03 129.26 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.449 0.642 . . . . 74.41 111.792 176.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -129.87 123.29 30.47 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 116.12 -0.491 . . . . 43.23 110.273 175.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.7 p90 -125.57 136.63 53.5 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.523 0.677 . . . . 74.44 112.734 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 64.9 m -103.56 123.16 46.43 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.512 -0.767 . . . . 62.32 110.936 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.669 HD12 ' HD2' ' A' ' 54' ' ' ARG . 42.4 mm -94.22 114.13 30.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.68 0.276 . . . . 75.23 111.67 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -104.43 111.07 23.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.952 0.406 . . . . 74.1 111.317 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.8 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.2 pt? -92.17 136.55 33.09 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 110.06 -0.348 . . . . 74.52 110.06 173.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.04 120.26 12.3 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.077 0.465 . . . . 64.52 110.903 -176.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -71.1 120.33 16.51 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.683 0.623 . . . . 54.42 112.683 -171.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -135.92 127.2 28.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.905 -0.589 . . . . 65.43 109.884 173.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -70.42 95.93 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.709 0.633 . . . . 73.22 112.709 -171.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.9 m80 -71.63 173.11 8.52 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.495 -0.32 . . . . 62.42 110.727 171.815 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 62.77 29.45 16.72 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 121.009 0.433 . . . . 73.44 110.823 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.533 -0.746 . . . . 73.32 112.18 -178.941 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' N ' ' A' ' 2' ' ' GLU . 6.3 tmm? . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 110.062 -0.347 . . . . 55.11 110.062 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.528 ' N ' ' SD ' ' A' ' 1' ' ' MET . 26.5 mt-10 -132.62 137.71 47.13 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.072 0.463 . . . . 72.43 111.788 -175.556 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.539 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.3 ttt -139.33 106.91 5.58 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.943 -0.571 . . . . 72.42 111.247 -170.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.482 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 16.0 m-20 -90.89 106.93 18.86 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.476 0.311 . . . . 62.45 111.39 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.9 mm -97.51 109.3 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.706 0.289 . . . . 75.34 111.208 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 2.5 ttp180 -118.67 116.35 26.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.325 0.583 . . . . 72.11 112.097 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -95.15 142.57 27.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.839 -0.618 . . . . 74.51 111.379 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -141.91 121.11 13.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.144 -0.48 . . . . 73.34 111.222 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.61 -165.22 36.47 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.964 -0.636 . . . . 35.22 113.311 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -123.66 102.13 7.67 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 122.48 -0.424 . . . . 60.23 111.867 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -176.82 141.86 0.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.051 -0.522 . . . . 75.34 110.416 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.1 tp -76.01 -44.48 39.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 111.97 0.359 . . . . 74.45 111.97 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 4.8 mp0 -73.97 -27.52 61.03 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 112.1 0.407 . . . . 53.43 112.1 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -47.59 68.12 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.193 0.812 . . . . 31.12 113.193 -173.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -60.95 -61.27 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.22 0.452 . . . . 65.44 112.22 -176.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.46 -39.38 91.93 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.597 0.591 . . . . 73.4 112.597 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 10.5 mmmt -65.83 -52.93 46.41 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.27 0.47 . . . . 62.31 112.27 -179.412 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.8 88.19 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.294 0.568 . . . . 61.52 110.791 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 tp -63.26 -41.44 99.05 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.682 -0.69 . . . . 53.53 111.43 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -57.22 -48.46 78.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.157 -0.474 . . . . 65.53 111.935 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -60.61 -44.87 95.81 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.09 0.472 . . . . 74.32 111.384 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 96.3 mmm -61.53 -49.08 78.15 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.192 -0.458 . . . . 72.42 111.525 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.82 -37.68 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 120.741 0.305 . . . . 73.35 111.366 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -53.67 -47.9 69.96 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.892 0.377 . . . . 75.54 111.119 177.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.642 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 72.2 mm-40 -74.35 -40.16 62.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.322 -0.399 . . . . 64.24 111.276 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.13 -38.58 79.97 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.308 0.484 . . . . 50.33 112.308 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -59.92 -29.55 68.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.061 0.458 . . . . 72.35 111.466 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.642 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 50.7 mtpt -72.22 -13.81 61.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.162 -0.472 . . . . 73.33 111.759 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -110.46 -177.26 3.19 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.013 0.435 . . . . 70.32 111.167 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -96.93 -10.72 25.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.765 0.317 . . . . 54.43 111.746 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.34 150.61 51.95 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.488 -0.387 . . . . 74.11 113.76 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 144.52 27.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.028 0.442 . . . . 63.14 111.518 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.444 HG22 HG23 ' A' ' 46' ' ' ILE . 84.5 t -129.36 131.61 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.161 -0.472 . . . . 53.53 111.045 178.15 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -131.8 140.25 49.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.733 0.302 . . . . 45.1 110.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -131.8 151.48 51.64 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.291 0.478 . . . . 74.2 112.291 -174.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 t -137.26 131.68 32.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.062 -0.517 . . . . 65.55 111.33 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mm? -100.91 123.61 45.36 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.947 0.403 . . . . 75.34 111.271 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -121.7 83.86 2.16 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.26 0.552 . . . . 71.32 110.209 174.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.23 -101.2 0.3 Allowed Glycine 0 CA--C 1.528 0.857 0 CA-C-N 115.752 -0.658 . . . . 62.41 113.159 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -108.58 21.77 16.84 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.059 0.457 . . . . 55.11 111.437 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -127.94 140.5 51.96 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 116.087 -0.506 . . . . 73.11 110.377 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 31.7 tp -134.17 118.81 18.07 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.104 0.409 . . . . 74.33 112.104 -177.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -108.83 131.77 54.66 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.641 0.257 . . . . 72.2 110.743 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -127.11 109.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 120.88 0.372 . . . . 71.5 110.981 -179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 45' ' ' ARG . 15.2 ttp85 -92.48 108.54 20.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.002 0.429 . . . . 73.21 111.402 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.444 HG23 HG22 ' A' ' 33' ' ' VAL . 58.2 mt -102.74 136.63 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 116.11 -0.496 . . . . 52.45 111.369 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.8 m -144.04 121.77 11.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 122.24 -0.288 . . . . 63.14 111.386 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 133.04 -27.8 3.41 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 120.87 -0.681 . . . . 62.45 114.275 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.3 m -71.24 134.64 84.91 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 122.238 -0.566 . . . . 72.24 111.7 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.97 153.91 74.08 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.719 2.279 . . . . 64.21 113.512 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -56.73 -31.24 64.34 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.555 0.946 . . . . 62.41 113.555 -175.527 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -71.83 -33.88 68.84 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.411 0.523 . . . . 72.01 112.411 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -81.41 -30.12 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 121.186 0.517 . . . . 73.11 110.677 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.476 ' HE ' ' HB3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -49.09 -45.75 43.69 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.591 -0.731 . . . . 73.34 112.194 177.357 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -65.18 -31.03 72.0 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.865 0.364 . . . . 64.23 111.712 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -71.51 -44.67 64.24 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.091 0.472 . . . . 74.35 110.233 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.34 -35.78 81.52 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.045 -0.525 . . . . 72.45 111.15 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.38 -45.05 95.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.996 0.427 . . . . 74.02 111.247 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.2 -43.71 87.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.85 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.65 -42.23 86.97 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.132 -0.486 . . . . 74.5 111.191 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.79 -45.42 78.22 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.993 0.425 . . . . 71.2 111.418 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -64.99 -36.47 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.987 0.422 . . . . 72.24 111.034 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.421 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 9.9 tpp180 -59.49 -48.04 83.18 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.249 -0.432 . . . . 63.51 110.26 175.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.29 -43.6 74.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.695 -0.684 . . . . 75.02 111.627 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.56 75.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.185 0.517 . . . . 64.22 111.278 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.32 -38.01 86.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.966 -0.561 . . . . 72.45 111.409 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 8.1 mm-40 -53.27 -35.4 60.01 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.409 -0.36 . . . . 63.31 111.834 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -114.74 6.19 15.51 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.315 0.487 . . . . 73.33 112.315 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 60.83 24.97 14.89 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.844 0.354 . . . . 74.15 111.834 179.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -101.49 -179.51 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.902 0.382 . . . . 63.31 111.506 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 95.6 m -102.67 131.75 49.25 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.8 0.333 . . . . 74.41 111.778 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -111.09 134.2 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.261 0.553 . . . . 74.54 111.228 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.9 p -130.84 121.1 24.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.951 -0.568 . . . . 73.24 110.224 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 17.0 p90 -129.5 129.35 44.44 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.366 0.603 . . . . 64.44 112.51 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.9 m -103.73 119.17 38.36 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.561 -0.745 . . . . 64.41 110.518 178.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.539 HG12 ' HG3' ' A' ' 3' ' ' MET . 24.2 mt -122.95 133.83 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 122.063 -0.398 . . . . 73.42 112.029 -175.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.4 HH21 ' CD ' ' A' ' 2' ' ' GLU . 35.0 ptt180 -127.29 137.03 52.74 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.122 0.487 . . . . 70.35 111.155 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.583 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.1 pt? -135.45 165.11 26.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.037 -0.529 . . . . 71.54 110.962 178.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.5 97.12 0.41 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.252 0.549 . . . . 74.33 111.862 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -97.16 119.92 36.55 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.386 -0.37 . . . . 74.24 111.279 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.1 m80 -89.8 117.6 28.77 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.008 0.432 . . . . 75.14 111.702 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -74.99 75.98 2.2 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.118 0.485 . . . . 73.3 111.515 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.3 p80 -88.18 153.71 21.02 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.321 -0.4 . . . . 64.44 110.988 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -93.21 -176.54 4.18 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.892 0.377 . . . . 73.43 111.534 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.997 -0.525 . . . . 74.25 111.312 179.628 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.793 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 35.5 ttm . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.705 0.288 . . . . 75.42 111.022 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 77' ' ' ARG . 37.6 tt0 -127.2 132.63 50.42 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.683 0.278 . . . . 65.42 110.631 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.547 ' HG3' HG12 ' A' ' 76' ' ' ILE . 25.9 ttt -130.14 118.09 20.94 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 120.826 0.346 . . . . 73.22 111.576 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 13.4 t70 -97.49 114.66 26.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.832 0.453 . . . . 51.3 110.796 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 62.2 mt -121.84 113.54 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 122.372 0.269 . . . . 65.54 111.462 -177.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.543 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 6.0 ptm180 -106.93 138.06 43.82 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.136 0.493 . . . . 73.31 112.16 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.93 142.19 44.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.031 -0.531 . . . . 71.13 110.996 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.525 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 26.4 ttt85 -142.46 132.43 24.41 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.591 -0.277 . . . . 74.34 110.722 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.46 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -179.37 -165.48 33.61 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 120.441 -0.885 . . . . 75.31 113.949 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.23 -19.91 12.07 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 122.697 0.399 . . . . 74.12 111.885 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.3 118.2 8.31 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.18 0.514 . . . . 75.22 112.353 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.06 -61.01 2.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.978 -0.555 . . . . 55.15 112.352 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.573 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 43.5 tt0 -60.48 -26.64 66.96 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.057 0.391 . . . . 70.05 112.057 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.41 -28.79 31.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.676 0.274 . . . . 44.03 111.351 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.68 -60.36 3.67 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.336 -0.393 . . . . 65.05 111.337 174.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -71.01 -28.57 64.5 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.514 -0.312 . . . . 64.23 111.649 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HG2' ' HG2' ' A' ' 13' ' ' GLU . 31.8 mmmt -67.76 -54.91 15.46 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.863 0.363 . . . . 74.23 111.082 177.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -64.84 -51.59 61.24 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.261 -0.427 . . . . 73.15 111.437 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.97 -48.35 70.42 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.901 0.381 . . . . 74.51 111.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -60.85 -45.98 92.37 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.351 -0.386 . . . . 63.55 111.816 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 25' ' ' GLN . 17.3 mm-40 -64.15 -44.92 90.63 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.871 0.322 . . . . 72.34 111.871 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 96.6 mmm -56.56 -53.09 61.56 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.997 0.427 . . . . 63.35 111.335 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.558 ' HA ' HG21 ' A' ' 33' ' ' VAL . 60.9 mt -61.39 -41.07 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.243 0.544 . . . . 62.32 110.809 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.46 -36.6 64.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.594 -0.73 . . . . 64.33 111.995 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 21' ' ' GLU . 29.7 mm-40 -74.26 -54.18 8.24 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.997 0.427 . . . . 75.13 111.663 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.2 75.44 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.737 1.014 . . . . 73.14 113.737 -171.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -56.95 -27.81 61.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.232 0.827 . . . . 73.2 113.232 -174.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.06 -25.91 66.49 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.724 0.297 . . . . 52.33 111.688 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -107.88 -175.37 2.76 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.021 0.439 . . . . 70.22 111.802 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.38 33.5 0.35 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.005 0.431 . . . . 72.05 111.941 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.73 161.83 12.89 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.264 -0.493 . . . . 73.41 113.819 -175.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.7 m -132.22 135.96 46.67 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.463 0.305 . . . . 60.2 110.71 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 23' ' ' ILE . 95.0 t -98.25 113.86 34.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.044 0.45 . . . . 72.32 112.15 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 t -107.91 141.51 39.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.209 -0.45 . . . . 61.03 110.225 173.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 40.1 p90 -150.53 152.01 33.52 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.984 0.421 . . . . 74.23 112.094 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.3 t -132.36 138.58 47.79 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.078 -0.51 . . . . 75.54 111.5 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.18 140.35 37.47 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.918 0.389 . . . . 73.43 112.037 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.32 99.97 2.4 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.208 -0.451 . . . . 74.14 110.93 171.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.94 -95.13 0.06 OUTLIER Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.272 -0.49 . . . . 51.55 113.392 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -111.31 4.65 19.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.062 0.393 . . . . 74.23 112.062 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -108.47 137.68 46.03 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.321 0.582 . . . . 54.15 112.477 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 tp -134.3 99.46 4.39 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.36 -0.836 . . . . 73.33 110.452 176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 31.7 mt-10 -93.0 115.97 28.62 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.162 -0.337 . . . . 71.11 111.217 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 74.1 mt -114.11 109.93 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 116.243 -0.435 . . . . 75.44 111.907 -176.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -106.53 132.13 52.89 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.002 -0.436 . . . . 73.24 111.354 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.535 HG12 HG22 ' A' ' 33' ' ' VAL . 45.8 mt -107.63 114.35 46.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.082 0.468 . . . . 74.14 110.805 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.7 m -101.61 122.35 43.7 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.272 -0.422 . . . . 74.22 111.846 -178.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.85 49.6 1.15 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.251 -0.5 . . . . 61.34 114.335 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.3 m -122.81 144.91 43.96 Favored Pre-proline 0 N--CA 1.472 0.65 0 O-C-N 122.233 -0.569 . . . . 71.52 112.269 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.39 160.06 39.28 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.03 2.487 . . . . 74.23 112.109 172.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -62.39 -36.94 83.89 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.994 -0.441 . . . . 72.41 111.955 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -61.11 -19.99 62.12 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.122 0.487 . . . . 75.31 111.183 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.75 -36.5 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 116.063 -0.517 . . . . 62.21 110.889 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.793 ' HD2' ' SD ' ' A' ' 1' ' ' MET . 31.4 ttt180 -45.55 -53.08 9.52 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.242 0.544 . . . . 71.43 111.528 173.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -58.77 -34.12 71.07 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.915 -0.584 . . . . 74.04 111.674 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -75.54 -35.26 60.72 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.285 -0.416 . . . . 71.23 111.428 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.84 -45.04 94.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.076 0.465 . . . . 74.51 110.849 176.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 62' ' ' GLU . . . -60.76 -50.42 73.55 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.149 -0.478 . . . . 71.04 111.159 175.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -55.17 -36.8 66.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.156 -0.475 . . . . 70.14 112.21 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -75.12 -43.89 50.2 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.975 0.417 . . . . 71.01 111.112 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.06 -38.05 78.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.755 0.312 . . . . 61.23 111.78 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 7.1 mm-40 -53.38 -46.34 69.61 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.971 0.415 . . . . 74.3 111.047 175.928 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ttm-85 -61.67 -50.93 70.52 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.965 0.412 . . . . 75.35 110.694 178.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.83 -43.88 66.32 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.908 -0.587 . . . . 73.22 111.778 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.468 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -66.18 -57.32 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.012 0.434 . . . . 52.34 111.981 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -62.67 -43.07 99.75 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.43 0.53 . . . . 75.21 112.43 -175.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.43 -36.86 83.71 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.953 0.406 . . . . 75.53 111.804 -174.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.33 7.69 31.38 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.844 0.313 . . . . 65.13 111.844 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 58.38 27.69 15.74 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.028 0.442 . . . . 65.11 112.01 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 65' ' ' ALA . 24.5 pt -96.25 154.84 3.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 121.056 0.455 . . . . 72.23 111.062 178.402 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.525 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 45.8 p -88.31 143.14 27.2 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.959 0.409 . . . . 52.21 111.88 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 12.1 p -141.88 135.6 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.18 0.514 . . . . 75.25 112.172 -177.356 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.7 p -128.75 143.22 50.87 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.371 -0.377 . . . . 72.34 110.014 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 21.0 p90 -131.35 115.33 16.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.394 0.616 . . . . 73.24 112.279 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 96.6 m -104.19 124.93 50.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.729 -0.669 . . . . 74.22 110.418 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.547 HG12 ' HG3' ' A' ' 3' ' ' MET . 44.3 mt -118.64 139.81 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.131 0.491 . . . . 73.53 112.237 -174.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 2' ' ' GLU . 18.8 ptt180 -126.43 131.23 51.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.117 -0.492 . . . . 62.42 110.636 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.1 pp -134.85 168.76 18.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.697 0.628 . . . . 72.4 112.697 -173.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.75 85.64 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.937 -0.574 . . . . 75.15 111.913 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -72.69 126.01 28.87 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.915 0.388 . . . . 73.1 111.088 177.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -78.32 151.29 33.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.199 0.523 . . . . 74.31 112.33 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -104.35 106.74 17.35 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.811 -0.631 . . . . 65.2 111.071 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -111.94 -75.42 0.61 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.649 0.611 . . . . 73.51 112.649 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 62.49 35.71 14.5 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.205 0.526 . . . . 63.42 111.287 -173.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 37.9 m80 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.769 -0.634 . . . . 73.24 111.284 178.513 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.7 ' SD ' ' HD3' ' A' ' 54' ' ' ARG . 47.5 ttp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.715 0.293 . . . . 75.54 111.144 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.529 ' CD ' HH21 ' A' ' 45' ' ' ARG . 40.4 mt-10 -132.31 142.41 49.35 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.966 0.412 . . . . 75.52 111.36 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -133.06 118.63 18.99 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.289 0.566 . . . . 74.21 111.294 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -100.73 114.43 28.19 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.744 -0.662 . . . . 72.1 110.814 -178.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.1 mt -106.39 120.42 57.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.264 0.554 . . . . 74.41 111.365 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -103.7 105.32 15.51 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.067 -0.515 . . . . 72.14 111.747 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -93.56 146.98 23.4 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.156 0.503 . . . . 74.23 111.974 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -143.03 120.78 11.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.304 -0.407 . . . . 71.15 110.674 171.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.65 156.52 28.23 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.776 -0.726 . . . . 63.52 112.94 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -89.1 -30.15 18.86 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.807 0.336 . . . . 74.23 111.412 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.9 120.53 13.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.948 0.404 . . . . 62.44 111.793 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 48.1 tp -63.75 -41.27 98.04 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.993 0.425 . . . . 54.14 111.316 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.09 -36.8 71.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.088 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -40.56 83.53 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.332 -0.395 . . . . 75.41 111.423 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 12' ' ' LEU . 15.3 t80 -53.72 -58.68 6.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.193 -0.458 . . . . 72.34 111.74 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.69 -40.58 72.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.001 0.371 . . . . 72.22 112.001 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 67.9 mmtt -62.98 -46.7 86.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.393 0.516 . . . . 65.24 112.393 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.83 -49.05 79.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.902 0.382 . . . . 52.44 111.104 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -61.24 -41.02 96.17 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.128 0.489 . . . . 65.31 111.177 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -58.99 -54.86 42.42 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.768 -0.651 . . . . 74.33 111.802 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.99 -42.47 97.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.209 0.448 . . . . 72.01 112.209 -176.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 85.3 mmm -57.66 -48.57 79.13 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.119 -0.363 . . . . 73.3 111.148 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 63.0 mt -66.47 -38.44 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.212 0.53 . . . . 74.51 110.863 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.633 -0.712 . . . . 63.44 111.624 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -73.89 -40.92 62.83 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.641 0.258 . . . . 73.44 111.58 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.13 -29.97 64.03 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.856 0.687 . . . . 74.42 112.856 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.5 mtp180 -56.77 -29.57 62.77 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.378 0.51 . . . . 74.24 112.378 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HB3' ' NZ ' ' A' ' 28' ' ' LYS . 3.5 mmmp? -75.26 -13.27 60.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.038 0.447 . . . . 72.24 111.715 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -120.54 178.73 4.56 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.07 0.462 . . . . 73.24 111.281 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.99 38.0 0.33 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.193 0.52 . . . . 72.24 111.505 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.35 124.64 7.68 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 114.345 0.498 . . . . 71.41 114.345 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -101.38 117.76 35.6 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.691 0.396 . . . . 65.45 109.997 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.416 HG22 HG12 ' A' ' 46' ' ' ILE . 49.0 t -108.13 130.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 120.956 0.408 . . . . 63.43 112.047 -176.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -132.74 161.2 34.65 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.296 -0.411 . . . . 74.32 110.972 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 28.4 p90 -151.36 152.76 33.57 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.575 0.583 . . . . 72.11 112.575 -175.001 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 t -137.15 134.69 36.64 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.815 -0.63 . . . . 74.42 111.045 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.427 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.2 mm? -99.36 139.96 34.24 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.246 0.546 . . . . 73.4 112.3 -178.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -142.89 86.0 1.91 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.971 -0.558 . . . . 75.3 110.529 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.56 -89.76 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 121.367 -0.444 . . . . 70.13 113.481 -178.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -95.44 -25.76 16.12 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.691 0.397 . . . . 62.24 111.781 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -93.16 147.22 23.07 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.539 0.685 . . . . 75.22 112.659 -171.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD21 HD11 ' A' ' 44' ' ' ILE . 43.3 tp -134.95 104.33 5.93 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.158 -0.928 . . . . 71.14 110.192 178.374 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.46 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.3 tt0 -94.35 111.08 22.8 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.701 0.286 . . . . 73.42 111.107 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.404 HD11 HD21 ' A' ' 42' ' ' LEU . 65.8 mt -112.78 109.85 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-N 116.435 -0.348 . . . . 70.12 111.341 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.529 HH21 ' CD ' ' A' ' 2' ' ' GLU . 61.8 ttt180 -104.64 120.01 40.33 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.981 0.419 . . . . 74.54 111.145 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.416 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -106.95 125.89 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.936 0.398 . . . . 75.33 111.299 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -121.34 136.59 54.94 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.346 -0.388 . . . . 34.43 111.762 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.19 -13.94 40.24 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.755 -0.736 . . . . 71.24 114.193 174.394 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.35 138.1 95.72 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 117.268 0.534 . . . . 75.35 111.837 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.475 ' HG2' HG23 ' A' ' 53' ' ' VAL . 42.7 Cg_endo -68.8 152.6 73.91 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.382 2.055 . . . . 72.14 113.361 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -45.24 -43.11 10.12 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.836 1.05 . . . . 75.31 113.836 -176.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.21 -37.66 87.99 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.642 0.608 . . . . 70.4 112.642 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.532 HG12 ' HG ' ' A' ' 57' ' ' LEU . 57.6 t -73.89 -23.51 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.025 0.441 . . . . 74.2 111.708 -177.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 42.8 ttp180 -46.68 -50.52 17.71 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.334 0.588 . . . . 74.04 111.708 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -59.27 -44.77 92.42 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.244 -0.889 . . . . 70.22 112.029 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -68.95 -48.42 63.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.038 -0.528 . . . . 64.52 111.67 -175.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.532 ' HG ' HG12 ' A' ' 53' ' ' VAL . 87.1 mt -59.66 -33.85 72.08 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.555 0.217 . . . . 72.32 111.524 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.194 0.521 . . . . 61.31 110.594 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 ttpp -57.45 -45.46 84.73 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.752 -0.658 . . . . 72.4 111.226 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.98 95.67 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.49 -0.323 . . . . 74.34 111.79 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.37 -42.55 87.26 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.102 0.477 . . . . 45.33 111.291 177.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.29 -42.4 93.17 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.222 -0.444 . . . . 74.24 111.336 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -64.92 -37.96 89.37 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.734 0.302 . . . . 52.11 111.139 177.332 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.8 mt -57.38 -43.22 83.41 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.947 0.404 . . . . 65.35 110.65 172.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.98 -51.52 69.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.072 -0.513 . . . . 74.35 111.776 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -67.79 -26.24 65.99 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.222 0.453 . . . . 72.03 112.222 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.94 -50.56 72.97 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.949 0.404 . . . . 64.41 111.63 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -108.54 7.27 26.69 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.17 0.433 . . . . 74.2 112.17 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.8 t30 58.57 66.61 1.05 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.321 0.581 . . . . 74.43 111.356 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.8 pt -130.46 172.23 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 116.17 -0.468 . . . . 70.13 111.23 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.7 m -96.34 135.68 37.85 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.585 -0.279 . . . . 74.23 111.324 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.29 138.76 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.171 0.51 . . . . 60.22 112.118 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.6 p -127.43 172.87 10.28 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.999 -0.546 . . . . 63.24 109.742 172.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -145.92 115.77 7.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.364 0.602 . . . . 70.11 112.451 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 97.4 m -93.18 104.54 16.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.689 -0.687 . . . . 64.32 110.139 173.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.498 HG21 ' HD2' ' A' ' 54' ' ' ARG . 52.8 mt -111.93 129.42 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.947 0.403 . . . . 65.43 111.811 -175.533 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -100.25 106.65 18.33 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.177 0.513 . . . . 65.34 111.086 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -142.51 110.66 5.99 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.915 -0.584 . . . . 72.22 109.692 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -73.85 148.98 41.87 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.304 0.573 . . . . 75.44 112.538 -176.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -127.77 80.72 1.98 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.914 -0.584 . . . . 75.23 110.754 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -98.36 102.45 14.19 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.307 0.575 . . . . 74.01 112.015 -178.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -146.99 173.47 12.41 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.653 -0.703 . . . . 73.3 110.258 176.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -136.38 15.21 3.21 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.178 0.513 . . . . 72.02 110.9 176.411 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -155.61 2.99 0.18 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 116.105 -0.498 . . . . 73.12 111.876 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 84.7 t60 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.998 -0.525 . . . . 61.02 111.61 -179.104 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.944 0.402 . . . . 73.53 111.358 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -115.11 148.02 39.49 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.244 -0.435 . . . . 70.53 110.949 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.505 ' HG3' HG12 ' A' ' 76' ' ' ILE . 27.1 ttt -130.6 107.69 9.37 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.182 0.515 . . . . 71.14 111.663 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.511 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 2.9 m-20 -81.91 104.6 12.39 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.875 -0.602 . . . . 72.13 111.158 176.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.7 mt -107.74 109.41 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 120.99 0.424 . . . . 70.24 111.281 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.73 107.06 18.16 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.568 -0.287 . . . . 72.45 111.549 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.03 138.56 31.3 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.553 -0.294 . . . . 74.11 110.226 172.223 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -137.54 120.29 16.28 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.806 0.336 . . . . 64.32 110.615 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.4 149.53 16.08 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.053 -0.594 . . . . 55.34 112.938 -178.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.04 23.67 1.72 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 120.831 0.348 . . . . 63.31 111.648 -178.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -119.53 120.84 37.92 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 120.888 0.375 . . . . 72.42 111.393 -175.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 49.9 tp -72.23 -38.25 68.98 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.153 0.427 . . . . 64.32 112.153 -176.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.45 -40.4 93.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.88 0.372 . . . . 74.34 111.221 178.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.4 -43.32 83.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.164 -0.471 . . . . 72.23 111.156 175.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.553 ' HE1' HD13 ' A' ' 42' ' ' LEU . 56.6 t80 -50.03 -55.31 15.28 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.684 -0.689 . . . . 63.14 111.577 176.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.64 -56.28 19.22 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.975 0.361 . . . . 73.13 111.975 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -61.97 -49.29 76.7 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.674 0.62 . . . . 71.24 112.674 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.46 -48.38 82.03 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.974 0.416 . . . . 64.23 111.574 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.9 tp -62.76 -43.39 98.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.045 0.45 . . . . 74.25 111.473 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -57.95 -47.85 81.68 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.88 -0.6 . . . . 62.21 111.763 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -66.66 -33.15 75.01 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.372 0.508 . . . . 72.04 112.372 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.42 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.4 mmm -66.07 -47.61 73.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.976 0.417 . . . . 73.42 110.895 176.435 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.71 -39.55 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 116.282 -0.417 . . . . 72.24 111.033 177.526 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.0 ttm-85 -54.58 -45.45 73.56 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.138 0.494 . . . . 73.04 111.204 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -72.45 -45.92 57.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.235 -0.439 . . . . 53.44 111.548 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.82 -34.96 70.22 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.245 0.461 . . . . 71.41 112.245 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -58.44 -28.72 65.55 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.043 0.386 . . . . 75.41 112.043 177.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -66.21 -33.66 76.26 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.13 0.491 . . . . 74.12 111.228 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -96.54 -178.03 4.13 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.216 -0.447 . . . . 72.13 111.425 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.18 4.12 43.71 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.21 0.448 . . . . 72.13 112.21 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.91 159.62 42.02 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.186 -0.53 . . . . 50.32 113.812 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.7 m -119.1 144.49 46.58 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 122.609 -0.348 . . . . 52.01 110.767 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.401 HG22 HG12 ' A' ' 46' ' ' ILE . 64.5 t -117.7 124.43 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 112.036 0.384 . . . . 71.42 112.036 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -118.31 148.69 42.22 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.441 -0.345 . . . . 63.43 110.483 172.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' LEU . 52.7 p90 -150.71 138.25 19.66 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.483 . . . . 73.43 112.138 -177.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.2 p -123.88 119.78 30.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.09 -0.504 . . . . 54.22 110.808 176.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.4 tp -93.73 101.47 13.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.119 0.485 . . . . 74.14 111.629 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -99.04 96.88 8.1 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.122 -0.49 . . . . 74.22 110.773 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.64 -90.33 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.3 -0.476 . . . . 64.14 113.154 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -119.6 -1.04 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.855 0.36 . . . . 73.5 111.11 179.354 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.15 121.81 44.59 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.273 -0.421 . . . . 75.4 111.396 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.553 HD13 ' HE1' ' A' ' 15' ' ' PHE . 64.6 tp -104.02 99.67 9.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.177 0.513 . . . . 73.42 110.659 176.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -85.28 104.52 15.2 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.215 -0.448 . . . . 72.34 111.197 179.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.5 mt -103.48 136.41 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.346 -0.388 . . . . 73.54 111.395 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -125.39 115.6 20.55 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.943 0.401 . . . . 71.05 110.771 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.401 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -101.64 115.3 43.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.036 0.446 . . . . 73.43 110.689 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.9 m -101.43 123.68 45.88 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.284 -0.416 . . . . 74.13 111.6 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.22 65.01 1.22 Allowed Glycine 0 CA--C 1.527 0.798 0 C-N-CA 121.091 -0.576 . . . . 73.11 113.46 176.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.6 m -113.85 133.87 22.2 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 122.551 -0.382 . . . . 71.11 111.923 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.453 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 37.5 Cg_endo -65.57 125.78 14.98 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.578 2.186 . . . . 73.32 112.837 178.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -54.7 -34.44 62.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.483 0.549 . . . . 75.43 112.483 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.528 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.7 pt20 -63.92 -40.02 95.5 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.737 0.303 . . . . 65.31 111.763 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.528 HG23 ' HG3' ' A' ' 52' ' ' GLN . 58.4 t -86.75 -19.07 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.816 0.341 . . . . 73.12 111.498 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HD2' HD13 ' A' ' 76' ' ' ILE . 16.4 ttp180 -48.81 -36.35 16.55 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.287 0.477 . . . . 63.14 112.287 -178.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -61.42 -40.97 96.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.879 0.371 . . . . 65.23 111.481 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -69.84 -35.94 75.15 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.798 0.333 . . . . 70.45 111.042 177.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.44 -43.2 91.15 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.057 0.456 . . . . 53.24 110.853 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.53 94.43 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.243 0.544 . . . . 75.33 110.865 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 27.9 ttpt -59.64 -50.74 72.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.025 -0.534 . . . . 63.03 111.189 174.527 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -69.64 -37.8 76.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.94 -0.573 . . . . 63.43 111.713 -174.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.17 -51.82 55.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.042 0.449 . . . . 60.32 111.493 178.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 42.2 mt-10 -72.92 -31.49 64.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.484 -0.326 . . . . 63.24 111.357 176.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -57.3 -48.67 78.33 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.882 0.372 . . . . 72.31 110.306 178.419 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.9 mt -52.79 -47.3 67.68 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.991 -0.549 . . . . 63.33 111.188 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.81 -42.06 83.46 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.051 -0.522 . . . . 75.54 111.874 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 62.1 mttm -68.64 -26.61 65.42 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.404 -0.362 . . . . 73.14 111.664 -178.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -68.55 -48.99 62.84 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.198 0.523 . . . . 72.33 111.198 174.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -96.14 1.33 52.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.487 0.551 . . . . 62.42 112.487 -175.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 61.72 26.17 15.88 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.084 0.401 . . . . 71.33 112.084 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -103.65 175.58 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 121.215 0.531 . . . . 63.32 112.425 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.8 m -97.3 139.73 32.83 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 116.181 -0.463 . . . . 72.14 112.042 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -146.37 137.28 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.978 0.418 . . . . 73.11 111.663 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.4 p -128.66 139.11 52.41 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 116.664 -0.244 . . . . 53.45 110.594 175.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 43.5 p90 -127.27 119.38 26.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.363 0.601 . . . . 74.44 112.476 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . 0.443 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 71.7 m -103.55 139.81 38.37 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.733 -0.667 . . . . 74.33 109.714 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.505 HG12 ' HG3' ' A' ' 3' ' ' MET . 56.3 mt -131.15 128.49 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 121.864 -0.522 . . . . 75.14 112.408 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -85.82 105.69 16.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.884 -0.413 . . . . 75.44 109.884 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -100.8 124.86 47.07 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.118 0.485 . . . . 75.43 111.174 -174.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -91.17 104.77 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.936 -0.574 . . . . 74.42 110.976 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -124.25 143.13 50.72 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.011 0.434 . . . . 62.15 111.851 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -86.16 137.45 32.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.276 -0.42 . . . . 70.53 111.082 177.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.9 t60 -144.5 105.37 4.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.605 0.24 . . . . 61.1 111.344 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -80.41 151.22 29.48 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.232 0.539 . . . . 74.23 111.942 178.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -149.09 136.65 20.31 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.876 -0.602 . . . . 72.43 111.052 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.708 -0.663 . . . . 72.33 111.403 178.931 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.516 ' HE1' ' HA ' ' A' ' 51' ' ' GLU . 55.4 ttp . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 120.994 0.426 . . . . 72.15 111.532 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.07 146.3 51.06 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.573 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.0 ptm -131.65 121.95 25.15 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.9 0.704 . . . . 61.35 112.9 -175.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.55 ' HB3' ' NH1' ' A' ' 6' ' ' ARG . 3.8 m-20 -86.01 134.9 33.83 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.868 -0.605 . . . . 74.21 111.545 173.476 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.3 mt -139.24 133.24 39.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.101 0.56 . . . . 73.33 110.055 173.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.55 ' NH1' ' HB3' ' A' ' 4' ' ' ASP . 49.9 mtt85 -132.84 113.23 12.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.974 0.416 . . . . 72.32 112.02 -175.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.516 ' HE1' ' SD ' ' A' ' 22' ' ' MET . 97.0 m-85 -93.25 142.55 27.19 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.305 -0.407 . . . . 61.44 110.9 177.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.1 ttt180 -142.37 127.13 18.12 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.536 0.208 . . . . 70.24 111.514 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.558 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -170.27 -175.37 39.07 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 120.842 -0.694 . . . . 61.33 113.948 -178.348 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -95.2 -50.88 4.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.986 0.365 . . . . 74.11 111.986 -176.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -61.36 114.48 3.22 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.9 0.381 . . . . 73.11 111.049 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.55 -50.42 73.86 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.645 0.609 . . . . 64.21 112.645 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 22.0 mt-10 -56.23 -25.42 47.43 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.855 0.687 . . . . 72.54 112.855 -178.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.08 -34.02 59.08 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.754 0.311 . . . . 74.32 111.608 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.498 ' HB3' HD22 ' A' ' 42' ' ' LEU . 78.6 m-85 -72.05 -60.2 2.35 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.505 -0.316 . . . . 65.23 111.476 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 10.9 pt-20 -57.67 -40.67 79.9 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.122 0.416 . . . . 73.34 112.122 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -70.21 -42.45 72.32 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.1 0.407 . . . . 73.55 112.1 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -46.72 82.48 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.211 0.529 . . . . 64.43 110.415 174.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.427 ' HB2' HD21 ' A' ' 42' ' ' LEU . 64.3 tp -56.05 -43.57 78.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.69 -0.686 . . . . 72.1 111.247 175.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -56.14 -46.11 79.36 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.062 -0.517 . . . . 74.41 111.498 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -65.99 -40.26 91.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.714 0.292 . . . . 65.34 111.677 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' MET . . . . . 0.516 ' SD ' ' HE1' ' A' ' 7' ' ' PHE . 80.8 mtp -61.37 -53.29 58.52 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.72 0.295 . . . . 74.02 111.202 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.613 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 69.1 mt -59.49 -42.31 87.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-O 120.931 0.396 . . . . 74.01 110.506 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -48.41 -50.34 31.4 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.948 -0.569 . . . . 65.31 111.562 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -75.14 -33.02 61.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.913 0.387 . . . . 62.03 111.663 178.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -31.9 73.27 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.384 0.512 . . . . 61.35 112.384 -178.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 43.3 mtp180 -63.91 -27.84 69.42 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.93 0.395 . . . . 73.52 111.333 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -57.13 -25.03 58.17 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.136 -0.484 . . . . 74.12 111.486 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -120.16 167.74 11.92 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.988 0.423 . . . . 75.34 110.999 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.13 87.27 7.15 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.469 . . . . 54.11 110.748 176.6 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -146.42 157.68 27.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.836 -0.697 . . . . 72.03 113.474 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.9 m -106.98 128.81 54.68 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 122.793 -0.24 . . . . 72.52 111.276 -179.518 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -110.6 109.38 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 120.77 0.319 . . . . 73.23 111.33 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.6 p -101.06 130.46 47.09 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.392 0.277 . . . . 61.34 110.286 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 47.5 p90 -144.01 150.2 37.88 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.66 0.615 . . . . 71.55 112.66 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -139.28 133.59 31.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.993 -0.548 . . . . 71.35 111.398 171.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.8 tp -95.28 106.33 18.35 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.018 0.437 . . . . 71.01 110.483 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -126.82 118.23 24.22 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.023 0.44 . . . . 52.43 111.411 -172.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.04 -101.4 0.6 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.338 -0.458 . . . . 74.4 113.049 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -122.1 6.1 9.77 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 71.43 111.089 176.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.82 139.51 49.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.357 0.598 . . . . 71.33 112.067 -176.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.498 HD22 ' HB3' ' A' ' 15' ' ' PHE . 64.7 tp -108.02 101.72 10.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.102 -0.499 . . . . 72.01 109.84 172.065 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.519 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 7.9 tm-20 -81.52 115.04 20.64 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.925 -0.58 . . . . 74.51 110.556 -177.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -123.86 129.44 74.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 120.788 0.327 . . . . 74.21 111.616 -177.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -126.43 127.5 45.52 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 122.129 -0.357 . . . . 74.34 111.024 174.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.3 mt -111.89 124.22 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-O 120.976 0.417 . . . . 42.23 111.122 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -105.63 130.72 53.6 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.178 -0.465 . . . . 65.45 111.953 -177.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.67 28.47 8.89 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.197 -0.525 . . . . 61.55 113.832 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.484 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 13.7 m -89.63 134.72 31.81 Favored Pre-proline 0 CA--C 1.543 0.703 0 O-C-N 122.41 -0.465 . . . . 71.32 111.974 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 8.1 Cg_exo -74.9 144.77 31.04 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.862 2.375 . . . . 60.13 113.023 177.179 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 3.1 tm-20 -53.2 -48.43 68.11 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 120.98 0.419 . . . . 72.34 111.28 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.427 ' HG3' HG23 ' A' ' 53' ' ' VAL . 20.6 pt20 -56.13 -28.63 58.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.367 0.506 . . . . 74.12 112.367 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.427 HG23 ' HG3' ' A' ' 52' ' ' GLN . 46.4 t -94.92 -22.87 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.965 0.412 . . . . 74.33 111.262 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.435 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 23.2 ttp180 -50.84 -49.4 58.94 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.142 0.496 . . . . 73.14 111.598 179.575 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -54.77 -40.84 69.79 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.573 -0.74 . . . . 63.31 111.968 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.5 -44.87 66.75 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.414 -0.357 . . . . 74.21 111.437 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.409 ' HG ' HG12 ' A' ' 53' ' ' VAL . 94.4 mt -63.98 -42.96 97.06 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.773 0.32 . . . . 64.52 111.77 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.95 -50.04 72.36 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.894 0.378 . . . . 51.11 111.136 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 2.7 tmmm? -56.72 -47.55 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.135 -0.484 . . . . 74.51 110.531 175.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.49 -40.63 87.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.155 -0.475 . . . . 72.13 110.96 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.41 -46.26 86.79 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.929 0.395 . . . . 71.33 111.488 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.67 -41.61 95.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.069 0.461 . . . . 62.44 111.049 176.553 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.66 -42.03 98.14 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.356 -0.384 . . . . 70.24 111.289 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.25 -48.31 79.19 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.997 0.427 . . . . 63.12 111.179 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.413 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -53.53 -55.63 23.89 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.011 -0.54 . . . . 71.34 111.321 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -60.25 -35.47 75.55 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.228 -0.442 . . . . 72.1 111.975 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.96 -46.53 88.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.138 0.494 . . . . 74.13 111.397 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.18 7.58 43.68 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.488 -0.324 . . . . 65.51 111.783 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t30 58.82 32.93 22.71 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.583 0.706 . . . . 62.32 111.058 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.558 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.3 pt -111.78 164.09 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 116.178 -0.464 . . . . 42.2 111.512 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 53.9 m -94.98 134.67 37.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.382 -0.372 . . . . 64.24 111.039 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 12.7 p -122.96 135.8 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 121.27 0.557 . . . . 74.32 112.202 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.6 p -128.84 141.34 51.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.053 -0.521 . . . . 73.44 110.008 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -139.72 160.87 38.9 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.608 0.596 . . . . 62.42 112.608 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.1 m -149.93 109.67 4.06 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.785 -0.643 . . . . 75.35 110.154 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -106.09 127.95 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 112.148 0.425 . . . . 74.15 112.148 -174.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 1' ' ' MET . 45.9 mtt180 -107.96 116.47 32.02 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.284 -0.416 . . . . 72.43 111.125 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tt -117.78 125.23 50.23 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.882 0.373 . . . . 75.22 110.433 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.438 ' HB3' ' NE2' ' A' ' 82' ' ' HIS . 9.8 mp0 -71.84 96.13 1.62 Allowed 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.918 0.389 . . . . 62.14 111.191 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -81.01 166.14 21.07 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.561 0.578 . . . . 75.35 112.561 -175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.9 m170 68.81 9.63 7.47 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.547 0.739 . . . . 72.22 112.894 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' HIS . . . . . 0.438 ' NE2' ' HB3' ' A' ' 79' ' ' GLU . 6.0 m170 -73.47 99.17 2.93 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.36 0.504 . . . . 61.04 112.36 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -170.15 141.17 2.06 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.649 -0.705 . . . . 70.41 110.252 177.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -69.41 92.61 0.61 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.352 0.596 . . . . 75.35 110.922 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 20.3 p80 . . . . . 0 C--O 1.253 1.261 0 CA-C-N 115.474 -0.785 . . . . 71.33 112.559 -175.536 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.4 ' HE3' HG23 ' A' ' 49' ' ' VAL . 59.0 ttp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.809 0.338 . . . . 75.25 110.761 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.428 ' HG3' ' HA ' ' A' ' 47' ' ' THR . 4.5 mp0 -104.75 165.9 10.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.349 -0.387 . . . . 72.25 110.721 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.401 ' HG3' HD13 ' A' ' 76' ' ' ILE . 27.4 ttt -143.83 117.34 9.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.108 -0.37 . . . . 70.219999999999999 111.804 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 20.9 m-20 -94.62 103.85 15.79 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.812 0.339 . . . . 71.439999999999998 111.188 176.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.43 108.89 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.893 0.377 . . . . 71.230000000000004 110.563 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 58.0 mtp180 -99.94 107.21 19.12 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.604 -0.271 . . . . 64.519999999999996 111.497 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -90.35 126.58 35.92 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.796 0.331 . . . . 65.349999999999994 111.161 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 73.8 ttt-85 -127.06 120.12 28.22 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 110.067 -0.346 . . . . 74.549999999999997 110.067 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -142.57 -170.73 12.89 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 120.653 -0.784 . . . . 74.420000000000002 113.853 -172.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -103.9 -47.06 4.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.561 0.578 . . . . 72.409999999999997 112.561 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -100.83 152.79 20.1 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.961 -0.462 . . . . 73.430000000000007 111.688 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.97 -36.66 85.11 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.175 0.435 . . . . 72.439999999999998 112.175 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -58.53 -32.82 69.21 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.384 -0.371 . . . . 74.120000000000005 111.248 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.37 -45.48 80.5 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.063 0.459 . . . . 75.120000000000005 111.143 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -67.5 -47.05 71.12 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.142 0.496 . . . . 75.129999999999995 110.792 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -54.41 -57.94 9.37 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.723 -0.671 . . . . 71.420000000000002 112.14 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -65.33 -47.82 75.18 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.272 -0.422 . . . . 75.310000000000002 111.6 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.7 -51.2 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.403 . . . . 73.140000000000001 111.582 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.23 -45.06 88.39 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.139 0.495 . . . . 72.120000000000005 111.447 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -67.31 -31.73 72.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.141 -0.481 . . . . 63.32 111.752 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 27.0 mm-40 -70.18 -39.16 75.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.762 0.315 . . . . 73.310000000000002 111.444 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 90.5 mmm -59.93 -52.45 65.38 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.543 -0.299 . . . . 75.540000000000006 110.532 174.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.481 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 72.5 mt -58.02 -40.45 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.139 0.495 . . . . 70.140000000000001 111.209 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 68.9 ttt180 -48.52 -58.73 4.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.689 -0.687 . . . . 73.540000000000006 111.824 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -75.73 -39.22 57.63 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.41 0.522 . . . . 73.540000000000006 112.41 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.2 -30.03 59.11 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.563 0.579 . . . . 74.409999999999997 112.563 -175.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 74.9 mtp180 -59.87 -28.99 68.01 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.081 0.4 . . . . 71.129999999999995 112.081 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 12.7 mptt -74.16 -14.9 61.02 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.678 0.275 . . . . 71.099999999999994 111.56 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -110.79 149.47 30.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.84 0.352 . . . . 72.120000000000005 111.016 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.08 58.17 1.94 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.281 0.562 . . . . 61.299999999999997 111.559 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -131.0 133.15 7.13 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 116.107 -0.497 . . . . 75.549999999999997 112.276 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.4 m -85.97 117.83 25.06 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.857 0.361 . . . . 63.509999999999998 111.627 -176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -92.31 109.59 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.229 0.538 . . . . 64.450000000000003 111.927 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.4 p -113.41 153.58 28.37 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.153 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -156.43 149.05 23.69 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.667 0.617 . . . . 73.400000000000006 112.667 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.1 p -130.29 126.57 37.57 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.637 -0.71 . . . . 70.209999999999994 110.811 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.1 tp -97.87 99.42 10.74 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.048 0.452 . . . . 72.310000000000002 110.926 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -106.18 106.66 17.28 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.967 0.413 . . . . 72.040000000000006 110.838 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 60.7 -112.92 5.03 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.12 -0.562 . . . . 63.329999999999998 112.335 -175.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 47.3 t-20 -115.67 72.3 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.03 0.443 . . . . 72.219999999999999 110.175 173.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -175.99 122.28 0.18 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.576 -0.738 . . . . 63.450000000000003 109.785 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.2 tp -104.74 101.14 10.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 72.010000000000005 111.047 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -85.09 104.45 15.01 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.472 -0.331 . . . . 75.200000000000003 111.095 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.9 mt -99.6 109.07 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 111.773 0.286 . . . . 74.409999999999997 111.773 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -98.87 106.23 18.47 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.185 0.517 . . . . 62.020000000000003 111.578 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.9 mt -91.8 112.01 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 116.184 -0.462 . . . . 73.340000000000003 110.298 174.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.428 ' HA ' ' HG3' ' A' ' 2' ' ' GLU . 91.7 m -93.04 120.44 33.34 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.218 -0.446 . . . . 44.009999999999998 112.0 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.87 65.13 1.09 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.434 -0.412 . . . . 72.409999999999997 113.922 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.4 HG23 ' HE3' ' A' ' 1' ' ' MET . 16.4 m -122.06 136.56 26.4 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 122.405 -0.468 . . . . 74.540000000000006 111.914 177.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -78.65 150.8 24.72 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.598 2.199 . . . . 73.140000000000001 112.461 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -60.06 -30.63 69.34 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.852 0.686 . . . . 64.230000000000004 112.852 -174.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG3' HG23 ' A' ' 53' ' ' VAL . 28.9 pt20 -63.58 -45.62 89.59 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.948 0.404 . . . . 74.420000000000002 111.308 177.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.462 HG23 ' HG3' ' A' ' 52' ' ' GLN . 61.3 t -77.08 -27.72 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.869 0.366 . . . . 63.539999999999999 111.109 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.2 ttp180 -48.94 -40.98 32.38 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.161 0.505 . . . . 71.430000000000007 111.193 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -60.91 -51.84 67.58 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.822 -0.626 . . . . 71.420000000000002 111.311 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -62.09 -44.65 96.19 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.828 -0.624 . . . . 75.329999999999998 112.097 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.31 -45.68 75.79 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.771 0.319 . . . . 71.409999999999997 111.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.91 94.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.059 0.457 . . . . 73.439999999999998 111.508 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -72.27 -34.89 68.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.156 -0.475 . . . . 65.230000000000004 112.064 -178.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -71.39 -31.99 67.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.262 -0.575 . . . . 65.209999999999994 110.566 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.09 -44.09 78.67 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.951 0.405 . . . . 72.299999999999997 110.498 171.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -58.1 -50.0 74.99 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.335 0.588 . . . . 52.350000000000001 110.43 172.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 63' ' ' ARG . 13.5 tpt180 -53.41 -48.77 68.4 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.347 -0.842 . . . . 72.329999999999998 111.475 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.73 -50.69 72.39 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.182 0.515 . . . . 44.039999999999999 111.046 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.39 65.69 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.09 -0.504 . . . . 44.439999999999998 111.868 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -74.38 -59.8 2.56 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 122.372 -0.205 . . . . 74.040000000000006 111.463 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -35.45 70.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.304 0.483 . . . . 72.310000000000002 112.304 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -92.79 -6.87 48.0 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.185 -0.322 . . . . 74.25 111.8 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.1 t30 57.93 15.83 3.34 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.395 0.617 . . . . 71.549999999999997 111.828 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.1 pt -87.1 174.88 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.051 0.453 . . . . 65.150000000000006 111.84 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.1 m -90.01 139.06 30.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.196 -0.456 . . . . 75.409999999999997 111.317 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.2 p -135.67 126.6 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.183 0.516 . . . . 73.25 111.472 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 71.8 p -129.64 120.53 25.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.419 -0.355 . . . . 44.119999999999997 110.333 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -121.22 117.79 27.97 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.063 0.459 . . . . 75.439999999999998 112.019 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.8 m -98.82 116.86 31.99 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.902 0.382 . . . . 74.530000000000001 111.037 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.401 HD13 ' HG3' ' A' ' 3' ' ' MET . 42.6 mm -82.0 112.37 19.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 116.446 -0.343 . . . . 44.140000000000001 111.041 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 77' ' ' ARG . 19.3 mmm180 . . . . . 0 N--CA 1.469 0.518 0 CA-C-O 120.936 0.398 . . . . 72.519999999999996 110.552 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.411 ' HE2' ' HA ' ' A' ' 51' ' ' GLU . 75.3 mtm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.779 0.323 . . . . 74.030000000000001 111.468 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.585 ' HB2' ' HG3' ' A' ' 77' ' ' ARG . 39.8 mt-10 -124.32 163.09 22.42 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.281 0.563 . . . . 72.510000000000005 111.862 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.67 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 25.7 ttt -143.59 111.95 6.34 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.061 -0.518 . . . . 74.140000000000001 111.613 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.43 120.78 28.13 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.661 0.267 . . . . 71.319999999999993 111.043 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 44' ' ' ILE . 22.5 mt -124.64 147.64 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.876 0.37 . . . . 73.129999999999995 111.814 -174.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.05 110.37 8.44 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.429 -0.35 . . . . 74.510000000000005 110.987 170.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -89.28 124.18 34.17 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.825 -0.435 . . . . 71.239999999999995 109.825 172.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 58.2 ttt180 -124.24 125.44 44.4 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.024 0.44 . . . . 71.140000000000001 111.852 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 170.76 -168.12 41.24 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.846 -0.692 . . . . 43.310000000000002 113.608 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -123.07 90.17 3.24 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 122.666 0.386 . . . . 74.430000000000007 110.852 -179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -175.95 142.26 0.51 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.149 -0.478 . . . . 62.299999999999997 110.372 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 35.0 tp -89.28 -39.63 13.35 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 111.853 0.316 . . . . 73.420000000000002 111.853 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -66.66 -32.26 73.46 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 122.17 -0.331 . . . . 73.319999999999993 111.251 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.69 -41.91 70.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.057 0.456 . . . . 74.129999999999995 110.909 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.467 ' CD1' HD22 ' A' ' 42' ' ' LEU . 62.4 t80 -58.83 -56.74 18.27 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.797 -0.638 . . . . 63.539999999999999 111.502 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.08 -52.33 63.11 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.144 0.424 . . . . 71.409999999999997 112.144 -176.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -62.43 -54.59 38.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.763 0.653 . . . . 74.530000000000001 112.763 -176.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.46 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.15 -43.86 87.59 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.92 0.391 . . . . 75.230000000000004 111.558 -178.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.2 tp -66.81 -42.54 85.75 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.975 0.417 . . . . 72.530000000000001 111.327 177.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -59.33 -52.77 64.23 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.155 -0.475 . . . . 53.329999999999998 111.985 -177.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -60.93 -49.59 76.85 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.203 0.445 . . . . 74.209999999999994 112.203 -176.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 51.4 mtp -62.94 -40.81 98.78 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.739 0.274 . . . . 44.020000000000003 111.739 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.3 mt -64.16 -41.92 93.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 120.974 0.416 . . . . 62.420000000000002 110.624 174.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.3 -46.53 79.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.061 -0.518 . . . . 72.340000000000003 111.136 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' A' ' 28' ' ' LYS . 29.7 mt-30 -74.3 -36.11 63.72 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.308 0.484 . . . . 71.400000000000006 112.308 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.86 -47.1 87.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.934 -0.479 . . . . 73.310000000000002 111.618 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -59.63 -39.49 84.49 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.744 0.646 . . . . 72.450000000000003 112.744 -177.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 20.8 ptmt -69.37 -14.33 62.85 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.987 0.422 . . . . 75.129999999999995 111.372 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -108.43 15.18 24.15 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.445 -0.343 . . . . 73.0 111.119 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.88 16.81 10.63 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.532 0.567 . . . . 74.540000000000006 112.532 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -78.43 133.31 12.61 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 121.442 -0.409 . . . . 52.130000000000003 113.587 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.7 m -90.85 122.5 33.61 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.542 -0.387 . . . . 75.540000000000006 111.117 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.443 HG22 HG12 ' A' ' 46' ' ' ILE . 49.9 t -109.03 130.17 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 120.96 0.41 . . . . 70.219999999999999 111.871 -179.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.9 t -124.64 132.79 53.4 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.519 -0.309 . . . . 74.420000000000002 110.794 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.524 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.7 p90 -128.34 144.92 51.19 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.369 0.507 . . . . 73.209999999999994 112.369 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 37.8 p -137.84 133.24 33.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.96 -0.564 . . . . 72.239999999999995 111.13 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.55 115.44 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.747 0.308 . . . . 72.200000000000003 111.31 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -114.21 81.39 1.53 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.383 0.611 . . . . 65.230000000000004 111.496 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.72 -85.09 0.03 OUTLIER Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.814 0.685 . . . . 55.310000000000002 114.814 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -100.06 -10.74 21.21 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.473 0.546 . . . . 51.310000000000002 112.473 -171.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -146.51 160.87 41.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.065 0.765 . . . . 71.420000000000002 113.065 -175.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 35' ' ' TYR . 50.6 tp -101.49 116.31 32.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.501 -0.772 . . . . 72.329999999999998 111.883 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB2' ' OG1' ' A' ' 36' ' ' THR . 38.0 mt-10 -79.83 129.96 34.92 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.536 -0.302 . . . . 70.200000000000003 110.725 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 5' ' ' ILE . 66.5 mt -134.58 121.86 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 122.407 0.283 . . . . 73.040000000000006 111.069 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 3' ' ' MET . 42.5 ttm180 -118.66 120.84 38.63 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.073 0.463 . . . . 61.200000000000003 111.032 174.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' ' 2' ' ' GLU . 49.7 mt -101.49 129.08 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 116.121 -0.49 . . . . 74.510000000000005 110.777 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.424 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 57.5 m -120.89 143.39 48.95 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.313 0.245 . . . . 71.409999999999997 111.6 -176.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.44 10.91 60.14 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.119 -0.562 . . . . 72.25 114.396 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.465 HG21 ' HE ' ' A' ' 54' ' ' ARG . 19.2 m -89.39 136.4 29.98 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 117.32 0.56 . . . . 74.430000000000007 112.077 179.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -73.09 174.32 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.976 2.451 . . . . 71.219999999999999 113.316 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 13.7 pt-20 -66.42 -49.38 66.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.624 0.972 . . . . 73.230000000000004 113.624 -171.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.21 -41.48 85.7 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.883 -0.51 . . . . 75.209999999999994 111.262 -176.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.59 -31.45 48.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.182 0.515 . . . . 70.310000000000002 110.992 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.67 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 3.8 tpm_? -52.51 -43.26 64.97 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 72.430000000000007 111.321 176.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.85 -52.85 62.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.811 -0.631 . . . . 62.43 111.68 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.74 -43.06 99.58 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.254 -0.43 . . . . 65.349999999999994 111.86 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.81 -36.77 84.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.961 0.41 . . . . 73.400000000000006 111.491 176.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.26 70.82 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.993 0.425 . . . . 65.349999999999994 111.328 176.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -78.3 -34.59 48.7 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 116.284 -0.416 . . . . 61.149999999999999 111.452 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.73 -41.49 97.71 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.776 0.287 . . . . 65.25 111.776 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -51.06 -43.59 60.99 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.103 0.478 . . . . 72.409999999999997 111.716 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.65 -41.68 95.48 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 111.416 176.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.1 tpt180 -62.71 -52.95 61.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.044 -0.526 . . . . 75.049999999999997 110.937 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 18' ' ' ALA . 86.4 mt -50.14 -48.54 53.68 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.89 -0.595 . . . . 71.099999999999994 111.998 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.46 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -58.78 -52.65 64.83 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.025 -0.534 . . . . 44.109999999999999 111.873 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -62.64 -35.05 78.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.601 0.593 . . . . 73.150000000000006 112.601 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.6 mm-40 -55.25 -47.69 75.06 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.251 0.548 . . . . 52.039999999999999 111.231 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -93.93 7.6 44.4 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.101 -0.499 . . . . 73.329999999999998 111.76 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.11 31.39 20.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.424 0.63 . . . . 71.310000000000002 111.559 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.5 pt -105.54 171.69 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.046 0.451 . . . . 64.340000000000003 111.23 177.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.45 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 47.8 p -97.99 143.04 28.97 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.928 0.394 . . . . 74.5 111.601 -179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 11.1 p -128.62 120.75 53.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.488 0.661 . . . . 62.140000000000001 111.986 176.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.5 p -116.09 136.01 53.42 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.761 -0.654 . . . . 75.299999999999997 110.178 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -149.39 155.07 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.014 0.746 . . . . 75.099999999999994 113.014 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 49.8 m -131.82 132.04 43.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.524 -0.762 . . . . 72.439999999999998 110.644 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 HH11 ' A' ' 54' ' ' ARG . 41.8 mm -94.15 122.11 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.575 0.226 . . . . 74.140000000000001 111.168 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.585 ' HG3' ' HB2' ' A' ' 2' ' ' GLU . 14.9 ptm180 . . . . . 0 CA--C 1.542 0.668 0 CA-C-O 121.482 0.658 . . . . 73.25 112.259 179.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 tmm? . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.826 0.346 . . . . 64.310000000000002 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -109.66 146.25 35.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.314 -0.403 . . . . 71.319999999999993 111.043 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.8 ptm -144.36 119.09 9.83 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.825 0.345 . . . . 75.329999999999998 111.928 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.82 130.79 38.31 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.292 -0.413 . . . . 73.129999999999995 111.188 177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.2 mt -132.95 112.84 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.376 -0.203 . . . . 71.030000000000001 111.38 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -102.73 121.74 43.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.861 0.362 . . . . 65.439999999999998 111.765 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -101.39 126.04 48.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.342 -0.39 . . . . 63.420000000000002 111.532 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -140.14 132.67 28.67 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.536 -0.302 . . . . 75.209999999999994 110.79 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.475 ' HA3' ' HB ' ' A' ' 70' ' ' ILE . . . 168.9 -173.68 43.45 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 119.977 -1.106 . . . . 75.409999999999997 114.72 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 2.5 m-20 -87.35 85.75 7.19 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.297 0.48 . . . . 65.140000000000001 112.297 -175.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 8.5 t70 178.77 164.92 0.84 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.968 0.507 . . . . 74.209999999999994 109.992 174.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.0 tp -113.76 -44.62 3.16 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.949 0.404 . . . . 54.009999999999998 111.035 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.55 -25.66 68.34 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.374 -0.376 . . . . 74.239999999999995 111.152 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.27 -29.03 30.85 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.81 0.338 . . . . 65.319999999999993 111.51 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.402 ' CE1' HD11 ' A' ' 37' ' ' LEU . 73.0 t80 -57.11 -60.15 4.03 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.133 0.492 . . . . 65.409999999999997 111.067 174.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 11.7 pt-20 -69.54 -38.56 77.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.319 -0.401 . . . . 72.510000000000005 111.567 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.443 ' HG3' ' HZ ' ' A' ' 68' ' ' PHE . 24.1 mmmt -56.75 -54.22 48.79 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 52.200000000000003 112.075 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.22 69.36 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.919 0.39 . . . . 72.230000000000004 111.846 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.7 -49.48 72.94 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.164 0.431 . . . . 53.399999999999999 112.164 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.0 tptp -61.37 -50.63 72.12 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.819 0.342 . . . . 75.540000000000006 111.672 -174.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -62.14 -43.82 98.0 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.0 0.37 . . . . 73.109999999999999 112.0 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -59.83 -45.38 92.56 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.631 0.253 . . . . 64.349999999999994 111.211 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.0 mt -63.26 -42.4 96.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.96 0.41 . . . . 74.010000000000005 110.918 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.28 -39.09 74.97 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.08 -0.509 . . . . 71.510000000000005 111.156 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -75.77 -50.2 15.94 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.072 0.397 . . . . 72.239999999999995 112.072 174.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.63 84.91 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.009 0.744 . . . . 75.129999999999995 113.009 -175.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.95 58.97 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.733 0.301 . . . . 64.540000000000006 111.701 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -54.86 -33.09 61.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.198 0.523 . . . . 74.510000000000005 111.073 175.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -111.91 -168.23 1.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.953 -0.567 . . . . 72.129999999999995 111.227 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 16.98 2.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.95 0.405 . . . . 73.519999999999996 111.778 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.84 108.19 2.78 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.452 -0.404 . . . . 45.049999999999997 113.331 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -82.9 135.49 34.9 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.8 -0.235 . . . . 72.140000000000001 110.988 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.6 t -113.28 125.32 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 112.256 0.465 . . . . 71.0 112.256 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 t -122.57 152.5 40.35 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.129 -0.487 . . . . 61.130000000000003 110.445 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.51 ' HB2' HD11 ' A' ' 42' ' ' LEU . 38.1 p90 -144.63 141.71 29.58 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.361 0.504 . . . . 71.319999999999993 112.361 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.0 p -133.91 135.8 43.85 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.287 -0.415 . . . . 65.209999999999994 111.152 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.402 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.58 127.56 35.26 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.596 0.236 . . . . 61.43 111.53 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -123.16 94.15 4.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.132 0.492 . . . . 74.310000000000002 111.645 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.78 -75.54 0.72 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.303 -0.475 . . . . 73.430000000000007 113.718 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -139.75 11.38 2.47 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.523 0.564 . . . . 73.129999999999995 112.523 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -137.47 159.97 40.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.392 0.615 . . . . 75.219999999999999 112.446 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 35' ' ' TYR . 58.0 tp -105.7 119.21 38.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.667 -0.697 . . . . 64.340000000000003 111.823 -179.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.506 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 29.7 mt-10 -91.18 104.14 16.74 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.459 -0.337 . . . . 64.030000000000001 111.233 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.49 109.61 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 120.691 0.281 . . . . 74.099999999999994 111.578 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 45' ' ' ARG . 31.1 ttp180 -110.93 125.99 54.25 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.076 0.465 . . . . 72.030000000000001 111.666 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.0 mt -108.12 139.53 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 116.415 -0.357 . . . . 62.140000000000001 110.808 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.8 m -120.42 130.61 54.42 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.386 0.513 . . . . 72.049999999999997 112.386 -175.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.75 40.53 45.15 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.907 0.723 . . . . 64.430000000000007 114.907 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.8 m -95.23 152.85 39.69 Favored Pre-proline 0 N--CA 1.469 0.516 0 O-C-N 122.302 -0.529 . . . . 74.530000000000001 111.592 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.465 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 11.3 Cg_endo -55.11 117.16 3.72 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.779 2.319 . . . . 74.430000000000007 112.724 176.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.39 -29.97 11.29 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.955 0.724 . . . . 72.209999999999994 112.955 -178.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.457 ' O ' ' HE3' ' A' ' 55' ' ' LYS . 29.8 pt20 -76.11 -46.59 28.08 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.142 0.423 . . . . 73.409999999999997 112.142 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.465 ' HB ' ' HG2' ' A' ' 50' ' ' PRO . 58.8 t -67.61 -19.94 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-O 121.31 0.576 . . . . 51.299999999999997 110.844 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 7.0 ttp180 -46.17 -33.58 3.69 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.688 -0.687 . . . . 73.420000000000002 112.374 175.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 52' ' ' GLN . 17.1 ptpt -60.29 -45.11 94.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.715 0.293 . . . . 72.510000000000005 111.455 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -74.84 -34.15 62.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.744 0.307 . . . . 73.540000000000006 111.18 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.36 -48.38 78.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.906 0.384 . . . . 62.340000000000003 111.248 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.04 -38.97 83.14 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.082 0.468 . . . . 60.420000000000002 110.982 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -58.77 -43.46 90.4 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.805 -0.634 . . . . 73.430000000000007 111.136 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -60.26 -42.35 95.17 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.124 -0.489 . . . . 73.5 110.996 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.462 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -53.84 -49.03 69.33 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.967 0.413 . . . . 72.510000000000005 111.618 177.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.34 -36.37 83.49 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.072 0.463 . . . . 52.229999999999997 111.259 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -69.08 -37.01 78.23 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.358 -0.383 . . . . 64.150000000000006 111.333 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 61' ' ' ALA . 79.7 mt -59.57 -44.01 93.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.277 0.56 . . . . 54.149999999999999 110.223 174.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.88 -48.55 81.29 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.78 -0.646 . . . . 40.329999999999998 111.038 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -60.58 -33.79 73.24 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.306 0.484 . . . . 72.230000000000004 112.306 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -57.56 -36.86 72.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.12 0.486 . . . . 75.099999999999994 111.049 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.443 ' HZ ' ' HG3' ' A' ' 17' ' ' LYS . 85.4 m-85 -111.05 7.06 21.34 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.204 -0.453 . . . . 74.049999999999997 111.25 177.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 55.58 28.51 11.99 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.06 0.544 . . . . 74.319999999999993 112.151 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.475 ' HB ' ' HA3' ' A' ' 9' ' ' GLY . 32.2 pt -95.18 -178.25 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 112.675 0.62 . . . . 74.310000000000002 112.675 -176.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.1 m -91.79 141.37 28.74 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.97 -0.559 . . . . 61.310000000000002 111.694 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.41 118.71 23.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.041 0.448 . . . . 63.509999999999998 111.237 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -115.22 120.84 41.05 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.266 -0.271 . . . . 64.340000000000003 110.469 177.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -127.92 137.3 52.24 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.301 0.572 . . . . 62.420000000000002 112.308 -175.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.0 m -113.74 111.67 22.18 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.001 -0.545 . . . . 52.130000000000003 110.822 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -123.03 116.01 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.725 0.297 . . . . 65.239999999999995 111.312 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 . . . . . 0 N--CA 1.47 0.537 0 C-N-CA 122.522 0.329 . . . . 70.010000000000005 110.757 179.656 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.835 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.9 mtp . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.01 0.433 . . . . 62.200000000000003 111.382 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' A' ' 77' ' ' ARG . 0.6 OUTLIER -122.51 119.11 29.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.791 -0.818 . . . . 74.319999999999993 108.791 178.098 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.583 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.0 ttt -124.38 122.21 37.06 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.017 1.117 . . . . 75.510000000000005 114.017 -165.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' A' ' 75' ' ' THR . 1.0 OUTLIER -89.61 123.94 34.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.314 -0.857 . . . . 72.299999999999997 110.272 171.415 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 41.0 mt -130.4 108.73 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.958 0.409 . . . . 74.5 111.257 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -109.49 108.04 18.38 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.428 0.529 . . . . 53.5 112.428 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -89.84 156.04 18.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.836 -0.62 . . . . 74.140000000000001 110.708 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.537 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 42.1 ttp180 -142.42 120.4 12.06 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.171 0.51 . . . . 73.319999999999993 111.387 171.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.94 131.53 2.38 Favored Glycine 0 CA--C 1.522 0.507 0 CA-C-N 115.826 -0.625 . . . . 40.240000000000002 112.493 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.68 -5.44 55.15 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 122.427 -0.455 . . . . 64.430000000000007 111.654 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 14' ' ' ALA . 9.6 m-20 -73.02 101.22 3.18 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 73.010000000000005 110.709 174.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 30.4 tp -61.97 -26.98 68.53 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.046 0.387 . . . . 74.230000000000004 112.046 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -73.44 -36.35 65.89 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.024 -0.423 . . . . 73.400000000000006 110.527 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 11' ' ' ASP . . . -66.74 -31.75 72.6 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.819 175.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.451 ' HE1' HD13 ' A' ' 42' ' ' LEU . 60.6 t80 -55.26 -48.17 74.38 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.114 0.483 . . . . 75.209999999999994 110.331 171.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 9.0 tm-20 -60.45 -50.42 73.66 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.824 -0.626 . . . . 74.109999999999999 110.86 176.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -56.63 -54.35 47.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.403 0.52 . . . . 74.319999999999993 112.403 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -56.17 -53.36 58.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.891 0.33 . . . . 70.200000000000003 111.891 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.48 -36.74 83.45 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.061 0.458 . . . . 73.519999999999996 110.786 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.9 tptm -59.03 -51.05 71.72 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.041 -0.527 . . . . 72.340000000000003 111.73 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.577 ' HG3' HD21 ' A' ' 64' ' ' LEU . 7.8 mm-40 -61.65 -47.52 85.0 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.913 -0.585 . . . . 72.530000000000001 111.82 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.521 ' HB3' HD11 ' A' ' 46' ' ' ILE . 51.3 mmm -61.88 -40.38 95.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.781 0.324 . . . . 74.310000000000002 111.301 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.0 mt -67.79 -37.58 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 120.787 0.327 . . . . 72.209999999999994 110.867 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 21' ' ' GLU . 60.2 ttp85 -54.91 -42.5 72.25 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.884 0.373 . . . . 74.310000000000002 111.094 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -74.19 -48.04 31.73 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.951 0.405 . . . . 72.430000000000007 111.509 175.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.77 -46.66 71.04 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.752 0.649 . . . . 71.450000000000003 112.752 -175.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -56.4 -34.3 66.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.603 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -72.84 -32.63 65.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.072 0.463 . . . . 63.340000000000003 111.372 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.43 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 24.9 m-85 -96.35 -6.28 38.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.321 -0.399 . . . . 74.349999999999994 111.854 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 62.12 27.21 16.4 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.126 0.489 . . . . 64.099999999999994 111.516 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.94 156.87 36.75 Favored Glycine 0 CA--C 1.527 0.802 0 CA-C-N 116.126 -0.488 . . . . 74.120000000000005 113.262 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 78.0 m -88.32 128.66 35.49 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.731 -0.276 . . . . 74.219999999999999 110.949 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.509 HG22 HG12 ' A' ' 46' ' ' ILE . 61.1 t -123.78 114.47 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 121.047 0.451 . . . . 75.129999999999995 112.054 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.8 t -106.53 154.4 20.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.274 -0.421 . . . . 70.430000000000007 110.464 173.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.593 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 41.1 p90 -145.67 138.08 25.66 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.094 0.473 . . . . 74.230000000000004 112.144 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.8 p -132.9 134.43 44.56 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.119 -0.491 . . . . 74.519999999999996 111.049 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.57 100.91 12.32 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.777 0.322 . . . . 52.549999999999997 111.133 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -97.61 97.58 9.17 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.828 0.346 . . . . 73.040000000000006 110.864 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 -78.04 0.13 Allowed Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.357 -0.449 . . . . 62.240000000000002 113.055 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -143.31 15.81 1.86 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.541 -0.388 . . . . 74.120000000000005 111.342 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' ' HD3' ' A' ' 8' ' ' ARG . 3.9 m-20 -107.17 128.67 54.61 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.217 -0.447 . . . . 74.450000000000003 111.211 177.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.451 HD13 ' HE1' ' A' ' 15' ' ' PHE . 46.8 tp -95.5 101.72 13.46 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.278 0.561 . . . . 54.229999999999997 111.358 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.593 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.7 tt0 -89.53 107.18 18.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.108 -0.497 . . . . 74.530000000000001 111.642 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.8 mt -113.07 117.62 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 122.624 0.369 . . . . 71.349999999999994 110.88 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 4' ' ' ASP . 74.0 mtt180 -116.86 122.92 45.75 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.823 -0.548 . . . . 71.019999999999996 111.865 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 22' ' ' MET . 51.2 mt -110.0 115.06 48.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.995 -0.548 . . . . 71.120000000000005 111.593 -176.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 2' ' ' GLU . 60.4 m -100.48 127.01 46.94 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.116 -0.493 . . . . 74.230000000000004 111.548 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.43 57.29 1.13 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 121.152 -0.547 . . . . 62.439999999999998 113.627 175.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.515 HG23 ' HB2' ' A' ' 1' ' ' MET . 18.5 m -118.11 138.73 25.81 Favored Pre-proline 0 CA--C 1.541 0.63 0 CA-C-O 120.748 0.309 . . . . 52.310000000000002 111.445 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 16.8 Cg_exo -68.14 140.46 49.49 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.008 2.472 . . . . 75.430000000000007 113.389 -177.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.835 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 11.6 pt-20 -54.64 -41.08 69.63 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.73 0.641 . . . . 44.43 112.73 -178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -66.14 -24.09 66.6 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.271 0.471 . . . . 73.549999999999997 112.271 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.528 HG12 ' HG ' ' A' ' 57' ' ' LEU . 40.1 t -84.53 -10.19 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-O 120.912 0.387 . . . . 75.040000000000006 111.684 -177.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' HD12 ' A' ' 76' ' ' ILE . 4.1 tpt180 -43.73 -45.17 6.99 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.641 0.377 . . . . 72.439999999999998 111.989 175.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.96 -31.44 72.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.157 -0.474 . . . . 73.230000000000004 111.836 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -77.07 -53.85 7.27 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.873 0.368 . . . . 70.510000000000005 111.694 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.528 ' HG ' HG12 ' A' ' 53' ' ' VAL . 82.5 mt -56.0 -53.52 55.9 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.582 0.586 . . . . 75.310000000000002 112.582 -174.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.18 -40.6 94.5 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.966 0.413 . . . . 51.420000000000002 111.51 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -62.66 -40.94 98.62 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.319 -0.4 . . . . 71.030000000000001 111.539 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -74.2 -34.8 63.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.826 0.346 . . . . 75.310000000000002 111.262 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.71 -47.49 85.43 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.911 0.386 . . . . 55.109999999999999 110.879 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.48 -31.47 71.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.43 -0.35 . . . . 73.120000000000005 111.34 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -55.59 -53.37 57.35 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.981 -0.377 . . . . 74.420000000000002 109.981 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.577 HD21 ' HG3' ' A' ' 21' ' ' GLU . 54.4 mt -49.87 -43.08 49.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.925 -0.579 . . . . 64.239999999999995 112.047 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -57.39 12.88 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.001 0.429 . . . . 44.409999999999997 111.577 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -69.6 -28.21 65.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 120.999 0.428 . . . . 44.210000000000001 111.828 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.73 -36.99 59.78 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.07 0.548 . . . . 70.099999999999994 111.805 -176.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -111.56 7.49 20.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 120.896 0.379 . . . . 64.010000000000005 111.883 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 66.24 13.38 9.14 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.36 0.664 . . . . 75.319999999999993 112.088 176.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.7 pt -88.64 178.26 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 116.55 -0.295 . . . . 63.119999999999997 111.186 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.537 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 57.0 p -107.1 156.06 19.19 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.063 0.459 . . . . 72.129999999999995 112.144 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.78 131.8 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 121.35 0.595 . . . . 71.150000000000006 111.686 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.8 p -132.05 121.76 24.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.154 -0.475 . . . . 72.109999999999999 110.072 174.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -129.49 130.06 45.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.903 0.705 . . . . 73.400000000000006 112.903 -176.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.496 ' O ' ' HB3' ' A' ' 4' ' ' ASP . 68.3 m -113.84 121.91 45.45 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.683 -0.689 . . . . 54.020000000000003 110.783 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.583 HG12 ' HG3' ' A' ' 3' ' ' MET . 25.1 mt -101.08 126.83 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.128 0.49 . . . . 72.319999999999993 112.306 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 26.0 mmm180 . . . . . 0 CA--C 1.539 0.549 0 CA-C-N 116.129 -0.487 . . . . 71.219999999999999 110.917 175.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.578 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 69.3 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.836 0.351 . . . . 70.299999999999997 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.74 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 40.2 mt-10 -95.2 132.92 39.63 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 109.711 -0.477 . . . . 72.340000000000003 109.711 170.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.504 ' O ' ' HA ' ' A' ' 45' ' ' ARG . 23.8 ttt -114.49 106.54 14.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.988 0.423 . . . . 70.430000000000007 110.23 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 12.5 t70 -99.67 108.44 20.8 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.197 -0.456 . . . . 35.340000000000003 111.241 -172.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 58.6 mt -127.83 111.81 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 116.426 -0.352 . . . . 73.349999999999994 110.654 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -118.32 119.79 35.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.343 0.592 . . . . 75.510000000000005 112.265 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -94.17 155.53 17.01 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.802 -0.635 . . . . 73.209999999999994 111.237 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -124.13 120.02 31.13 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.888 0.375 . . . . 75.049999999999997 110.192 168.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.9 135.36 10.71 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.945 -0.645 . . . . 74.209999999999994 113.306 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.41 -43.68 59.97 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.849 0.357 . . . . 72.140000000000001 111.667 177.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -88.58 -171.48 3.35 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.067 0.46 . . . . 74.230000000000004 112.124 -178.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 54.1 tp -95.93 -52.55 4.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.545 0.572 . . . . 74.340000000000003 112.545 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -61.58 -26.75 68.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.932 0.716 . . . . 64.439999999999998 112.932 -172.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.5 -30.98 44.01 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.978 0.418 . . . . 43.119999999999997 111.026 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -59.77 -57.8 11.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.845 -0.616 . . . . 71.040000000000006 111.365 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.59 -51.16 59.48 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.131 0.419 . . . . 64.329999999999998 112.131 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 35.8 mmtp -55.27 -54.31 45.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.435 -0.348 . . . . 75.129999999999995 111.721 -176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.72 -51.99 59.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.972 0.36 . . . . 63.25 111.972 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.488 ' HB2' HD21 ' A' ' 42' ' ' LEU . 67.2 tp -55.88 -48.53 75.41 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.369 -0.378 . . . . 72.120000000000005 111.822 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -62.35 -40.84 97.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.248 0.462 . . . . 62.140000000000001 112.248 -176.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 18.6 mm-40 -60.05 -51.56 69.1 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.624 0.25 . . . . 71.510000000000005 111.174 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.4 mtp -59.38 -44.57 92.75 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.019 0.438 . . . . 72.310000000000002 111.268 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 54.0 mt -60.37 -37.15 73.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.407 -0.36 . . . . 62.399999999999999 111.219 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -57.73 -53.38 58.89 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 111.397 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -68.55 -41.61 79.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.852 0.316 . . . . 63.140000000000001 111.852 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.5 96.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.736 0.643 . . . . 74.239999999999995 112.736 -176.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 27' ' ' ARG . 28.5 mtp85 -60.04 -27.53 67.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.626 0.602 . . . . 72.239999999999995 112.626 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -58.16 -23.95 57.14 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.399 0.618 . . . . 70.430000000000007 110.965 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -114.21 -164.6 0.94 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.949 -0.569 . . . . 72.219999999999999 110.706 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.11 9.83 11.65 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.88 0.371 . . . . 53.219999999999999 111.599 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.25 86.95 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 CA-C-N 116.198 -0.456 . . . . 71.439999999999998 113.589 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 m -71.55 117.03 12.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.806 0.336 . . . . 71.530000000000001 110.963 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 56.6 t -99.19 125.23 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.38 0.511 . . . . 64.450000000000003 112.38 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.1 t -121.14 138.53 54.16 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.302 -0.408 . . . . 74.219999999999999 110.799 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.558 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.2 p90 -134.19 137.15 44.22 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.366 0.506 . . . . 75.049999999999997 112.366 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 p -124.35 138.96 54.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.198 -0.455 . . . . 72.129999999999995 111.187 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -108.08 131.6 54.43 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.045 0.45 . . . . 51.5 111.918 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -145.01 119.96 9.99 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.294 -0.412 . . . . 53.130000000000003 110.588 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 -86.72 0.07 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.105 -0.569 . . . . 73.510000000000005 112.99 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -144.92 10.77 1.36 Allowed 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.042 0.449 . . . . 71.319999999999993 111.45 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -95.32 122.78 38.38 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 111.514 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 19' ' ' LEU . 33.6 tp -96.45 103.92 15.86 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.138 -0.483 . . . . 65.400000000000006 110.578 173.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.2 mt-10 -90.08 104.46 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.353 -0.385 . . . . 75.519999999999996 111.464 -177.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -105.24 109.46 27.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.73 0.3 . . . . 74.299999999999997 111.451 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 3' ' ' MET . 37.9 ttm180 -111.82 115.27 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.86 -0.525 . . . . 75.420000000000002 111.364 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 44.7 mt -92.99 137.03 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.508 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.9 m -125.51 125.2 42.88 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 111.862 0.319 . . . . 62.439999999999998 111.862 -175.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.16 58.93 1.91 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.362 -0.447 . . . . 72.5 114.143 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 18.5 m -117.16 144.63 34.1 Favored Pre-proline 0 N--CA 1.474 0.735 0 O-C-N 122.248 -0.56 . . . . 74.010000000000005 111.912 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.66 130.73 32.57 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.412 2.075 . . . . 71.120000000000005 111.626 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.18 -28.58 62.94 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.533 0.938 . . . . 72.349999999999994 113.533 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -68.1 -38.01 81.81 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 122.062 -0.399 . . . . 73.450000000000003 111.287 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -77.69 -27.23 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 121.129 0.49 . . . . 64.299999999999997 110.89 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.578 ' NH1' ' SD ' ' A' ' 1' ' ' MET . 50.3 ttp180 -49.0 -38.7 24.09 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.74 -0.664 . . . . 71.329999999999998 111.517 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -60.18 -49.09 79.01 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.166 -0.47 . . . . 74.400000000000006 111.751 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -66.98 -41.51 86.68 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.08 -0.509 . . . . 64.299999999999997 112.285 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.33 -42.96 99.54 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.864 0.364 . . . . 63.100000000000001 111.312 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.36 94.95 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.224 0.535 . . . . 72.439999999999998 111.138 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -67.93 -31.14 70.69 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.836 -0.62 . . . . 64.329999999999998 111.541 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.77 -33.32 70.65 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.977 0.418 . . . . 63.420000000000002 110.39 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.4 91.87 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.121 0.486 . . . . 52.020000000000003 110.925 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.95 -41.74 92.5 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.353 0.596 . . . . 71.129999999999995 110.534 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -57.16 -48.99 77.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.76 -0.654 . . . . 75.450000000000003 111.087 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.57 -40.23 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.174 -0.466 . . . . 74.219999999999999 111.392 177.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.45 -49.01 78.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.192 -0.458 . . . . 64.219999999999999 111.279 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.14 -33.82 76.92 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.938 0.399 . . . . 72.140000000000001 111.271 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.39 -55.24 29.78 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.186 -0.461 . . . . 75.109999999999999 111.489 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -93.24 2.52 56.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.272 0.471 . . . . 73.540000000000006 112.272 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m120 58.63 31.87 21.56 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.068 0.461 . . . . 74.519999999999996 111.297 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 29.2 pt -103.88 171.55 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-O 121.148 0.499 . . . . 62.240000000000002 112.004 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 97.7 m -98.49 141.37 31.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.106 -0.497 . . . . 53.030000000000001 111.301 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -147.54 142.99 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.41 -0.359 . . . . 72.450000000000003 111.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.1 p -118.71 147.88 43.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.751 0.31 . . . . 43.43 110.78 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.4 p90 -143.82 123.9 13.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.122 0.487 . . . . 72.25 111.969 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.9 m -131.81 143.61 50.32 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 116.381 -0.372 . . . . 65.219999999999999 111.4 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.31 105.66 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-O 121.197 0.522 . . . . 65.109999999999999 111.545 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.74 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 19.6 mtp180 . . . . . 0 CA--C 1.54 0.592 0 CA-C-O 121.328 0.585 . . . . 63.539999999999999 111.209 178.762 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tmm? . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 110.298 -0.26 . . . . 51.439999999999998 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.549 ' HG2' HG23 ' A' ' 47' ' ' THR . 36.3 mt-10 -135.88 140.99 44.53 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.864 0.466 . . . . 70.510000000000005 110.714 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 14.8 ptm -144.23 120.06 10.57 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.202 0.445 . . . . 74.5 112.202 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.626 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 29.4 m-20 -90.67 104.63 17.19 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.548 -0.296 . . . . 64.030000000000001 110.919 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.3 mt -103.8 109.2 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.726 0.298 . . . . 62.009999999999998 110.936 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 4.8 ptp180 -108.47 125.61 51.97 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.256 0.55 . . . . 74.120000000000005 112.26 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -102.85 132.06 49.31 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.475 -0.784 . . . . 52.130000000000003 111.371 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -142.94 119.9 11.32 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.578 0.228 . . . . 71.209999999999994 110.665 174.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.86 160.28 30.22 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 120.826 -0.702 . . . . 74.450000000000003 113.312 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -86.3 89.05 7.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.968 0.414 . . . . 75.439999999999998 112.006 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -165.33 165.64 19.27 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.067 -0.515 . . . . 74.219999999999999 109.996 173.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -106.85 -52.16 2.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.673 0.273 . . . . 65.120000000000005 111.6 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.58 -25.6 62.26 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.313 0.486 . . . . 54.130000000000003 112.313 -178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.53 -30.17 40.37 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.078 0.399 . . . . 72.109999999999999 112.078 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CE1' HD21 ' A' ' 37' ' ' LEU . 59.7 t80 -58.96 -60.22 4.21 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.821 0.343 . . . . 71.420000000000002 111.178 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.74 -44.4 86.02 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 111.285 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.11 -56.13 26.03 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.081 -0.509 . . . . 62.100000000000001 112.084 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -44.33 96.13 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.119 0.485 . . . . 52.450000000000003 111.624 -177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 23' ' ' ILE . 45.0 tp -62.09 -56.16 21.69 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.93 -0.577 . . . . 63.409999999999997 111.779 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -63.09 -41.21 99.34 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.127 0.417 . . . . 52.200000000000003 112.127 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -54.97 -47.72 74.2 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.609 0.242 . . . . 71.329999999999998 111.515 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 45.0 mtp -72.77 -36.39 67.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.667 0.27 . . . . 74.400000000000006 111.552 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 19' ' ' LEU . 63.7 mt -57.29 -34.53 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.739 0.304 . . . . 75.5 111.274 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 24' ' ' ARG . 37.1 ttp180 -48.92 -46.72 43.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.304 -0.407 . . . . 71.209999999999994 111.577 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -74.46 -43.54 55.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.633 0.254 . . . . 73.019999999999996 111.297 174.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.08 -34.57 63.74 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.639 0.607 . . . . 71.510000000000005 112.639 -177.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HE ' ' HA ' ' A' ' 27' ' ' ARG . 6.5 mmp_? -60.53 -28.98 68.83 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.759 0.314 . . . . 72.299999999999997 111.65 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.408 ' HE3' ' N ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.61 -13.22 60.62 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.412 0.285 . . . . 62.0 111.746 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.73 151.54 28.81 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.211 0.529 . . . . 73.030000000000001 112.043 -177.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.21 57.05 1.05 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.015 0.436 . . . . 63.020000000000003 111.233 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.52 -168.26 12.98 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.344 -0.455 . . . . 52.509999999999998 113.491 -177.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 95.8 m -103.83 127.83 51.3 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.619 -0.342 . . . . 73.439999999999998 111.751 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.7 t -131.84 110.84 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.756 0.312 . . . . 74.409999999999997 110.705 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.3 t -121.76 162.5 20.73 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.922 0.391 . . . . 61.119999999999997 111.767 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.595 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 30.3 p90 -156.41 139.44 15.42 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.236 -0.438 . . . . 73.409999999999997 111.083 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 t -137.09 133.75 35.71 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.573 0.582 . . . . 73.140000000000001 112.573 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.403 HD21 ' CE1' ' A' ' 15' ' ' PHE . 3.6 mm? -94.19 102.21 14.23 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.072 -0.513 . . . . 70.239999999999995 110.99 176.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -118.27 106.0 12.33 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.065 0.459 . . . . 73.329999999999998 111.013 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.54 -85.22 0.44 Allowed Glycine 0 CA--C 1.525 0.695 0 C-N-CA 121.208 -0.52 . . . . 55.0 112.808 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -146.14 15.39 1.33 Allowed 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.763 0.316 . . . . 74.400000000000006 111.545 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -117.66 130.28 56.26 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.47 -0.332 . . . . 71.200000000000003 110.856 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 48.8 tp -102.94 102.6 12.68 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.437 -0.347 . . . . 73.030000000000001 111.271 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 27.3 mm-40 -87.97 106.57 18.21 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.515 -0.311 . . . . 50.030000000000001 111.177 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.41 HD11 HD21 ' A' ' 42' ' ' LEU . 54.1 mt -111.69 110.23 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 120.557 0.218 . . . . 73.120000000000005 111.001 177.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.3 ttt85 -107.1 122.6 46.8 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.945 -0.472 . . . . 73.420000000000002 111.721 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.5 mt -106.89 127.84 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 116.094 -0.503 . . . . 73.140000000000001 110.407 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -130.14 128.41 41.73 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.284 0.476 . . . . 71.230000000000004 112.284 -174.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.82 32.55 7.93 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 114.613 0.605 . . . . 45.0 114.613 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.67 141.44 24.65 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 117.506 0.653 . . . . 64.439999999999998 111.326 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.491 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 21.2 Cg_endo -59.14 133.62 54.21 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.797 2.331 . . . . 73.150000000000006 112.974 -178.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -59.58 -25.35 64.52 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.354 0.501 . . . . 71.420000000000002 112.354 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 50' ' ' PRO . 29.0 pt20 -60.34 -34.09 73.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.76 0.314 . . . . 75.129999999999995 111.743 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.456 HG23 ' HG3' ' A' ' 52' ' ' GLN . 42.9 t -91.49 -24.42 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.001 0.429 . . . . 75.209999999999994 110.827 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.624 ' HD3' HD13 ' A' ' 76' ' ' ILE . 5.9 tmm_? -47.88 -41.82 25.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.016 0.527 . . . . 64.420000000000002 111.49 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -61.2 -42.51 98.72 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.872 0.368 . . . . 74.439999999999998 111.81 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -66.0 -45.39 81.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.883 0.373 . . . . 72.530000000000001 110.684 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.34 -43.68 83.61 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.143 0.497 . . . . 72.420000000000002 111.247 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -64.07 -46.21 85.32 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.072 -0.513 . . . . 72.239999999999995 111.719 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -71.64 -34.19 69.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.19 0.441 . . . . 73.019999999999996 112.19 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.95 -37.16 86.39 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.169 0.509 . . . . 70.030000000000001 109.988 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -63.51 -38.79 92.48 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.889 -0.596 . . . . 64.099999999999994 111.163 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 45.5 mt-10 -58.07 -40.89 82.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.858 0.361 . . . . 75.549999999999997 110.968 175.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -61.24 -44.43 97.26 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.653 -0.249 . . . . 74.450000000000003 111.032 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.535 HD12 ' HA ' ' A' ' 61' ' ' ALA . 81.4 mt -50.46 -40.85 51.95 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.076 0.465 . . . . 75.439999999999998 111.127 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.613 ' HB2' HG12 ' A' ' 72' ' ' VAL . . . -65.8 -56.85 9.78 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.198 -0.455 . . . . 53.229999999999997 111.73 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.35 -23.92 67.11 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.19 -0.459 . . . . 72.019999999999996 112.087 -177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -82.44 -56.23 4.01 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.1 0.476 . . . . 74.409999999999997 111.431 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -94.05 4.61 53.66 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.153 0.427 . . . . 73.510000000000005 112.153 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 61.81 20.26 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.439 0.533 . . . . 61.219999999999999 112.439 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 23.8 pt -90.17 153.13 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 116.282 -0.417 . . . . 63.039999999999999 111.366 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.5 m -87.98 122.22 31.32 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.257 -0.277 . . . . 74.230000000000004 111.252 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.613 HG12 ' HB2' ' A' ' 65' ' ' ALA . 12.5 p -123.88 133.62 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.26 0.552 . . . . 71.219999999999999 111.591 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 p -142.62 142.02 32.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.219 -0.446 . . . . 72.109999999999999 110.713 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.626 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 13.6 p90 -137.24 128.59 28.14 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.822 0.675 . . . . 73.049999999999997 112.822 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.4 m -102.78 123.86 47.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.89 -0.596 . . . . 72.230000000000004 110.197 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.624 HD13 ' HD3' ' A' ' 54' ' ' ARG . 34.3 mt -122.99 139.46 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.78 0.659 . . . . 51.219999999999999 112.78 -169.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' A' ' 77' ' ' ARG . 14.0 ptm180 . . . . . 0 N--CA 1.468 0.438 0 CA-C-N 115.982 -0.554 . . . . 75.349999999999994 110.781 174.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 47.8 ttp . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.562 0.22 . . . . 72.299999999999997 110.826 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -125.8 153.51 43.95 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.245 0.461 . . . . 73.319999999999993 112.245 -175.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -148.29 112.14 5.11 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.951 -0.568 . . . . 73.120000000000005 110.979 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.581 ' HB3' ' HG2' ' A' ' 45' ' ' ARG . 2.3 p-10 -99.11 119.8 38.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.525 0.678 . . . . 74.510000000000005 111.866 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.515 HD13 ' HB2' ' A' ' 61' ' ' ALA . 56.4 mt -111.61 114.83 48.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 115.98 -0.555 . . . . 73.030000000000001 111.576 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.411 ' HD3' ' OD2' ' A' ' 41' ' ' ASP . 1.3 tmm_? -101.13 112.52 25.01 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.987 0.423 . . . . 73.040000000000006 111.549 -177.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 97.8 m-85 -91.19 156.04 18.14 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.75 0.309 . . . . 62.399999999999999 111.555 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 65.1 ttt180 -139.91 121.52 15.25 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.586 -0.279 . . . . 73.25 111.206 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.25 163.82 36.73 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.164 -0.541 . . . . 53.329999999999998 113.262 178.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -87.31 -35.74 18.25 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.946 0.403 . . . . 73.340000000000003 111.525 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.7 119.68 9.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.047 -0.524 . . . . 73.439999999999998 112.036 -177.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.95 -39.86 93.57 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.076 0.465 . . . . 71.219999999999999 110.87 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 1.8 mp0 -61.9 -27.88 69.13 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.091 -0.504 . . . . 74.329999999999998 111.744 177.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' A' ' 70' ' ' ILE . . . -58.97 -39.65 82.38 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.828 0.347 . . . . 75.540000000000006 111.13 177.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -67.89 -53.92 22.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.33 -0.396 . . . . 75.519999999999996 111.642 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.0 pt-20 -62.38 -42.56 99.51 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.1 0.407 . . . . 51.130000000000003 112.1 -177.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.499 ' NZ ' ' HB3' ' A' ' 17' ' ' LYS . 4.2 mmmp? -65.29 -42.62 92.93 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 122.296 -0.252 . . . . 74.25 111.437 178.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.525 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -62.24 -47.54 83.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.209 0.528 . . . . 72.019999999999996 111.432 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.14 -43.99 97.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 111.146 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -60.95 -48.31 82.4 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 111.593 -178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -57.95 -53.21 60.75 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.915 0.339 . . . . 73.140000000000001 111.915 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.418 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.3 mmm -59.55 -48.6 81.03 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.774 0.321 . . . . 72.519999999999996 111.704 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.608 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.8 mt -64.64 -42.77 96.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.764 0.283 . . . . 64.129999999999995 111.764 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -51.66 -47.44 63.79 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.727 0.299 . . . . 74.140000000000001 111.666 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -72.14 -44.23 63.45 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.83 0.348 . . . . 71.409999999999997 111.315 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.57 -31.46 69.47 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.003 0.742 . . . . 74.510000000000005 113.003 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 79.5 mtp180 -58.88 -28.47 66.17 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.023 0.379 . . . . 74.150000000000006 112.023 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.448 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -70.41 -13.56 62.19 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.962 0.41 . . . . 73.109999999999999 111.391 178.366 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.13 117.72 32.01 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.454 -0.339 . . . . 74.5 110.663 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.49 87.85 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.782 0.66 . . . . 74.549999999999997 112.782 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.31 -153.8 6.23 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 112.461 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.3 m -148.09 136.0 21.02 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.758 0.313 . . . . 63.329999999999998 111.188 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.1 t -117.42 124.76 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 120.994 0.426 . . . . 75.319999999999993 111.545 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.1 t -117.79 153.54 33.27 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.389 -0.369 . . . . 53.530000000000001 110.281 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.483 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 37.6 p90 -141.8 141.93 33.18 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.61 0.596 . . . . 71.109999999999999 112.61 -173.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 17.2 m -119.18 123.36 44.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.091 -0.504 . . . . 72.25 111.14 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.46 121.54 41.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.575 0.226 . . . . 73.230000000000004 111.203 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.73 84.53 2.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.093 0.473 . . . . 71.010000000000005 111.247 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.53 -91.84 0.04 OUTLIER Glycine 0 CA--C 1.532 1.11 0 CA-C-N 116.226 -0.443 . . . . 45.149999999999999 113.56 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 17.7 m-80 -95.91 -15.04 22.66 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 122.548 -0.383 . . . . 74.329999999999998 111.609 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.411 ' OD2' ' HD3' ' A' ' 6' ' ' ARG . 4.6 m-20 -97.83 149.41 22.39 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.766 0.654 . . . . 74.5 112.766 -173.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 38.0 tp -138.82 100.7 4.12 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.451 -0.795 . . . . 45.200000000000003 110.671 175.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.509 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 38.2 tt0 -89.78 104.37 16.94 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.56 -0.291 . . . . 75.230000000000004 111.387 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.75 108.72 24.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.964 0.412 . . . . 60.420000000000002 111.08 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 4' ' ' ASP . 94.1 mtt180 -97.82 108.91 21.72 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.743 0.306 . . . . 71.430000000000007 111.384 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.6 mt -94.48 121.94 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.76 0.314 . . . . 60.329999999999998 110.803 177.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.3 m -119.06 127.97 53.91 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.859 0.318 . . . . 60.200000000000003 111.859 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.91 61.79 1.26 Allowed Glycine 0 CA--C 1.527 0.837 0 C-N-CA 121.141 -0.552 . . . . 60.009999999999998 113.929 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.81 146.52 61.69 Favored Pre-proline 0 CA--C 1.542 0.669 0 O-C-N 122.504 -0.409 . . . . 60.149999999999999 111.554 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.73 137.59 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.514 2.143 . . . . 71.340000000000003 112.446 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG3' ' CZ ' ' A' ' 54' ' ' ARG . 36.4 tt0 -55.69 -36.73 67.47 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.879 0.696 . . . . 65.209999999999994 112.879 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.06 -30.58 68.17 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.041 0.448 . . . . 75.549999999999997 111.529 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.458 HG12 ' HG ' ' A' ' 57' ' ' LEU . 59.7 t -92.66 -32.33 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.515 -0.312 . . . . 73.549999999999997 111.281 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.554 ' HD2' HG21 ' A' ' 76' ' ' ILE . 46.4 ttp180 -47.22 -39.5 14.26 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.257 0.551 . . . . 72.420000000000002 111.338 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -52.9 -49.06 66.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.55 -0.75 . . . . 62.149999999999999 111.432 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.11 -34.87 59.48 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.114 -0.494 . . . . 72.340000000000003 111.556 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.458 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.9 mt -61.23 -33.33 73.32 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.027 0.441 . . . . 72.540000000000006 111.198 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.54 -39.08 88.4 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.017 0.437 . . . . 63.240000000000002 110.845 174.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -70.95 -29.55 65.59 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.35 -0.386 . . . . 72.530000000000001 111.638 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 7.1 mm-40 -54.77 -38.21 66.95 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.911 0.386 . . . . 71.209999999999994 110.523 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.546 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -58.22 -44.04 87.98 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.129 -0.487 . . . . 75.349999999999994 111.053 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.05 -41.46 97.38 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.244 -0.435 . . . . 75.530000000000001 111.146 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -63.21 -44.29 95.73 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.202 -0.454 . . . . 71.310000000000002 110.867 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 18' ' ' ALA . 96.2 mt -63.05 -37.18 86.18 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.084 -0.507 . . . . 62.539999999999999 111.606 178.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.19 77.89 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.197 0.522 . . . . 70.299999999999997 110.703 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.84 -25.93 63.97 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.039 -0.528 . . . . 63.310000000000002 111.687 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.12 -53.1 62.08 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.125 0.488 . . . . 61.439999999999998 111.367 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -110.52 16.64 21.41 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.05 0.389 . . . . 73.239999999999995 112.05 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 60.6 23.8 13.55 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.896 0.379 . . . . 74.040000000000006 111.917 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.549 HD13 ' HB1' ' A' ' 14' ' ' ALA . 31.2 pt -91.13 179.22 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.219 0.533 . . . . 61.399999999999999 111.933 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.5 m -101.33 149.86 23.6 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.208 -0.451 . . . . 71.310000000000002 111.223 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.546 HG21 ' HB1' ' A' ' 61' ' ' ALA . 11.2 p -144.92 133.85 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.423 0.63 . . . . 65.329999999999998 112.615 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -133.07 128.56 36.48 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.766 -0.652 . . . . 65.049999999999997 110.137 173.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -128.22 153.17 47.22 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.645 0.609 . . . . 72.329999999999998 112.645 -175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.3 m -127.49 132.69 49.94 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.846 -0.616 . . . . 44.43 110.737 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.554 HG21 ' HD2' ' A' ' 54' ' ' ARG . 39.5 mt -121.48 110.12 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.167 0.508 . . . . 72.150000000000006 111.564 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.3 ptm85 . . . . . 0 CA--C 1.537 0.458 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 111.35 -178.866 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE1' ' HD3' ' A' ' 54' ' ' ARG . 41.0 ttp . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.944 0.402 . . . . 44.219999999999999 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.416 ' N ' ' HG2' ' A' ' 1' ' ' MET . 29.9 mt-10 -100.04 147.0 26.09 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.196 -0.456 . . . . 54.439999999999998 110.293 173.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.469 ' HA ' HG12 ' A' ' 76' ' ' ILE . 21.7 ttt -148.36 108.25 4.03 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.11 0.481 . . . . 62.310000000000002 112.076 177.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.502 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 8.3 m-20 -92.97 110.15 21.61 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.116 -0.493 . . . . 73.439999999999998 110.627 174.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -115.6 116.88 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.739 -0.209 . . . . 72.519999999999996 110.78 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' ' HA ' ' A' ' 72' ' ' VAL . 1.8 ptp85 -105.76 128.51 53.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.338 0.496 . . . . 60.119999999999997 112.338 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -105.06 126.04 51.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.756 -0.656 . . . . 74.340000000000003 109.665 172.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -117.03 121.95 42.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.755 0.312 . . . . 73.239999999999995 111.238 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.52 157.97 19.58 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 116.043 -0.526 . . . . 65.329999999999998 112.346 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -93.46 -10.45 34.98 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.572 0.582 . . . . 70.140000000000001 112.572 -177.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.35 109.29 2.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.163 0.506 . . . . 71.319999999999993 111.369 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.2 tp -49.19 -55.51 12.24 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.31 0.855 . . . . 62.240000000000002 113.31 -174.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.3 69.17 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.311 0.486 . . . . 65.209999999999994 112.311 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.65 67.95 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.928 0.394 . . . . 74.219999999999999 111.046 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.455 ' CD1' HD22 ' A' ' 42' ' ' LEU . 64.5 t80 -53.6 -52.05 61.07 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.896 -0.593 . . . . 61.5 111.0 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -69.38 -54.21 15.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.761 -0.654 . . . . 70.409999999999997 111.983 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -55.91 -46.74 78.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.374 0.509 . . . . 63.130000000000003 112.374 -174.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.57 -54.7 11.04 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.887 0.329 . . . . 71.430000000000007 111.887 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.6 tp -55.91 -39.27 71.38 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.848 0.356 . . . . 70.140000000000001 111.508 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.09 -39.61 95.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.56 -0.291 . . . . 75.310000000000002 111.506 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -68.81 -41.56 78.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.725 0.298 . . . . 64.409999999999997 111.313 177.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 87.7 mmm -59.99 -47.61 85.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.001 0.429 . . . . 73.129999999999995 110.949 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.48 -44.64 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-N 116.203 -0.453 . . . . 63.329999999999998 110.978 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -49.62 -50.7 41.9 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.261 0.624 . . . . 74.129999999999995 111.964 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.554 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 2.8 mp0 -70.96 -41.21 71.39 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.31 -0.405 . . . . 75.430000000000007 111.739 178.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -33.62 74.34 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.34 0.496 . . . . 33.520000000000003 112.34 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -28.86 69.54 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.03 0.382 . . . . 62.109999999999999 112.03 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HE3' ' HA ' ' A' ' 25' ' ' GLN . 10.4 mtmp? -70.22 -13.94 62.4 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.063 0.458 . . . . 75.129999999999995 111.147 175.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -120.28 -172.25 2.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.095 -0.502 . . . . 73.049999999999997 110.559 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -94.51 36.2 1.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.172 0.51 . . . . 72.030000000000001 110.888 174.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.12 122.71 5.84 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-N 116.232 -0.44 . . . . 73.430000000000007 113.867 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.1 m -87.71 118.0 26.92 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.571 -0.37 . . . . 73.439999999999998 110.632 175.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.2 t -105.1 137.57 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.247 0.546 . . . . 72.430000000000007 112.291 -175.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 t -152.17 167.67 27.79 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.75 -0.659 . . . . 70.140000000000001 110.297 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -156.16 158.18 37.21 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.361 0.601 . . . . 75.129999999999995 112.345 -175.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 t -132.71 133.64 43.76 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.844 -0.616 . . . . 64.540000000000006 110.846 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.23 138.39 34.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.057 0.456 . . . . 73.349999999999994 111.814 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -143.44 89.6 2.09 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.223 0.535 . . . . 70.219999999999999 110.555 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.74 -99.34 0.47 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.13 -0.486 . . . . 42.210000000000001 112.503 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -114.14 12.8 17.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 120.883 0.373 . . . . 73.409999999999997 111.243 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -104.26 130.24 52.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.815 0.341 . . . . 55.119999999999997 111.26 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.455 HD22 ' CD1' ' A' ' 15' ' ' PHE . 47.8 tp -120.67 96.35 5.09 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.321 -0.4 . . . . 71.140000000000001 111.279 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -87.64 109.11 19.43 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.808 0.337 . . . . 70.439999999999998 110.832 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.7 mt -101.74 115.21 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 120.83 0.348 . . . . 72.329999999999998 111.925 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HD2' ' OG1' ' A' ' 47' ' ' THR . 0.8 OUTLIER -95.45 121.26 36.94 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.189 0.519 . . . . 65.439999999999998 111.146 175.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.476 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 47.1 mt -121.18 113.59 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.701 173.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.536 ' OG1' ' HD2' ' A' ' 45' ' ' ARG . 63.7 m -105.39 133.69 49.73 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.732 0.301 . . . . 55.219999999999999 111.365 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.84 -10.69 18.37 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.899 -0.667 . . . . 63.219999999999999 113.747 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.461 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 22.5 m -63.49 133.9 95.67 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 116.926 0.363 . . . . 74.430000000000007 111.689 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 14.3 Cg_exo -69.34 147.64 66.04 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.757 2.305 . . . . 73.319999999999993 113.616 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -46.68 -52.7 13.24 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.814 -0.63 . . . . 64.439999999999998 112.46 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -58.94 -29.88 67.45 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.487 0.551 . . . . 74.129999999999995 112.487 -177.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.541 HG12 ' HG ' ' A' ' 57' ' ' LEU . 42.6 t -79.29 -16.13 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 120.789 0.328 . . . . 52.439999999999998 111.652 -176.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB2' ' A' ' 58' ' ' ALA . 46.0 tpt85 -46.63 -37.87 8.82 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.104 0.562 . . . . 75.349999999999994 111.917 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -65.91 -54.86 21.04 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.472 -0.785 . . . . 74.5 111.94 -177.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -64.28 -37.18 86.59 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.959 0.355 . . . . 54.520000000000003 111.959 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.541 ' HG ' HG12 ' A' ' 53' ' ' VAL . 95.9 mt -60.34 -45.09 94.69 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.865 0.364 . . . . 61.420000000000002 111.458 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . . . -63.78 -45.65 88.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.103 0.478 . . . . 63.240000000000002 111.462 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -64.29 -31.76 73.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.035 -0.53 . . . . 54.450000000000003 111.316 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -72.69 -48.53 38.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.309 -0.405 . . . . 53.439999999999998 111.017 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.73 -42.32 71.43 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.22 0.452 . . . . 72.150000000000006 112.22 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.23 -48.7 78.14 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.734 0.302 . . . . 72.140000000000001 111.47 176.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -63.13 -37.07 85.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.272 -0.422 . . . . 73.400000000000006 110.823 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.66 -43.6 96.25 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.99 0.424 . . . . 65.230000000000004 111.612 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.06 14.43 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.18 0.437 . . . . 70.010000000000005 112.18 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -62.47 -30.7 71.44 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.033 0.382 . . . . 73.099999999999994 112.033 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -53.56 -39.5 64.82 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.837 0.351 . . . . 71.209999999999994 111.229 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -112.24 12.65 20.37 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 111.855 0.317 . . . . 73.219999999999999 111.855 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.3 t30 59.75 23.86 12.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.241 0.543 . . . . 55.520000000000003 111.898 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 32.1 pt -93.5 170.16 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.829 -0.544 . . . . 75.340000000000003 111.45 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.7 m -94.84 148.26 22.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 116.531 -0.304 . . . . 75.329999999999998 111.713 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 13.6 p -146.72 133.25 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 120.996 0.427 . . . . 33.140000000000001 111.997 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.6 p -132.67 167.6 19.79 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 122.161 -0.337 . . . . 51.25 110.988 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -125.35 146.23 49.67 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.948 0.404 . . . . 52.219999999999999 111.908 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 99.0 m -140.22 122.82 16.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.269 -0.423 . . . . 65.140000000000001 110.654 174.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 3' ' ' MET . 66.0 mt -134.2 132.12 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 112.031 0.382 . . . . 51.049999999999997 112.031 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.3 mtm180 . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 109.839 -0.43 . . . . 75.129999999999995 109.839 172.563 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.946 0.403 . . . . 72.319999999999993 110.711 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 2.3 tm-20 -137.49 130.99 31.19 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.926 -0.398 . . . . 64.450000000000003 109.926 -175.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.546 ' SD ' HG13 ' A' ' 76' ' ' ILE . 12.8 tpt -115.89 120.3 38.77 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.955 1.095 . . . . 74.409999999999997 113.955 -161.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -97.87 120.67 38.67 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 116.471 -0.331 . . . . 64.430000000000007 110.777 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.414 HG13 ' HG3' ' A' ' 3' ' ' MET . 62.7 mt -127.07 140.04 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-O 120.822 0.344 . . . . 64.439999999999998 111.028 177.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.42 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 67.0 mtt85 -137.89 121.7 17.6 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.951 -0.468 . . . . 74.099999999999994 112.001 -178.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.417 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 75.8 m-85 -100.33 144.9 28.79 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.94 0.4 . . . . 64.420000000000002 111.61 178.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 43.7 ttm180 -143.06 131.48 22.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.388 -0.369 . . . . 65.420000000000002 110.613 174.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 168.53 -145.94 9.98 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 119.845 -1.169 . . . . 73.209999999999994 114.355 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 28.3 t70 -139.36 174.14 10.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 122.528 0.331 . . . . 72.200000000000003 111.138 -175.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.434 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 26.8 t70 84.89 137.11 0.05 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 74.129999999999995 112.103 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.8 -49.07 61.63 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.013 -0.54 . . . . 73.319999999999993 111.743 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.57 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 44.8 mt-10 -59.95 -34.35 73.14 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.609 0.242 . . . . 72.530000000000001 111.227 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.75 -44.4 69.93 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.933 0.397 . . . . 72.200000000000003 110.734 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.78 -60.28 3.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 111.912 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 9.3 pt-20 -65.36 -41.86 93.4 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.647 0.61 . . . . 75.409999999999997 112.647 -172.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -71.69 -46.58 58.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.219 -0.301 . . . . 73.430000000000007 111.6 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -61.17 -48.93 79.28 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.86 0.362 . . . . 73.450000000000003 111.027 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 23' ' ' ILE . 59.6 tp -58.33 -44.14 88.53 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.436 -0.347 . . . . 64.450000000000003 110.908 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.05 -47.75 80.19 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.476 -0.329 . . . . 71.120000000000005 111.68 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 21.9 mm-40 -58.94 -38.7 79.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.821 0.343 . . . . 54.43 111.592 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 86.9 mmm -67.64 -37.94 83.13 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.675 0.274 . . . . 74.019999999999996 111.036 176.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 19' ' ' LEU . 76.4 mt -64.7 -40.16 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.1 0.476 . . . . 65.420000000000002 110.569 174.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -57.57 -41.7 81.61 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.204 0.526 . . . . 74.099999999999994 110.663 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 21' ' ' GLU . 68.2 mt-30 -66.06 -45.16 82.31 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.149 -0.478 . . . . 73.540000000000006 110.636 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.44 ' HB2' HG21 ' A' ' 33' ' ' VAL . . . -55.97 -34.42 65.71 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.763 -0.653 . . . . 65.049999999999997 112.701 -178.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 10.3 mmm180 -63.13 -29.21 70.62 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.834 0.349 . . . . 71.25 111.422 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -79.81 -18.33 51.18 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.058 0.392 . . . . 55.229999999999997 112.058 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -94.38 125.42 39.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.964 0.411 . . . . 52.530000000000001 111.704 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.06 59.17 2.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.181 0.515 . . . . 43.149999999999999 111.223 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.78 -136.88 2.59 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 115.99 -0.55 . . . . 62.25 113.05 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.1 m -142.68 139.21 31.08 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.919 0.34 . . . . 73.099999999999994 111.919 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.555 HG22 HG23 ' A' ' 46' ' ' ILE . 98.3 t -121.65 137.1 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 121.013 0.435 . . . . 70.340000000000003 111.608 178.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.3 p -117.58 150.84 38.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.052 -0.522 . . . . 63.100000000000001 111.003 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.651 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.9 p90 -155.88 131.95 9.99 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.203 0.525 . . . . 64.129999999999995 112.383 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 t -137.29 139.62 41.03 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.16 -0.473 . . . . 72.230000000000004 111.465 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.1 140.67 29.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.904 0.383 . . . . 64.230000000000004 111.788 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -141.81 86.95 2.02 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.157 0.503 . . . . 73.239999999999995 110.6 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.98 -94.93 0.15 Allowed Glycine 0 CA--C 1.524 0.649 0 CA-C-N 116.19 -0.459 . . . . 65.540000000000006 112.972 -178.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -107.68 -7.34 16.45 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.754 0.312 . . . . 74.109999999999999 111.116 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -93.71 150.92 20.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.244 0.545 . . . . 71.409999999999997 111.812 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' HG13 ' A' ' 44' ' ' ILE . 29.8 tp -138.39 102.21 4.57 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.846 -0.616 . . . . 71.25 110.898 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.651 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 36.3 mm-40 -78.18 111.23 13.9 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.027 -0.533 . . . . 63.509999999999998 111.026 178.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.435 HG13 ' HG ' ' A' ' 42' ' ' LEU . 62.8 mt -122.03 109.79 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.053 0.454 . . . . 74.420000000000002 111.24 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -112.71 127.16 56.05 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.993 0.425 . . . . 65.030000000000001 110.995 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.555 HG23 HG22 ' A' ' 33' ' ' VAL . 54.7 mt -111.34 109.77 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.092 0.473 . . . . 74.530000000000001 111.047 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 89.4 m -98.68 109.26 22.04 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.083 -0.508 . . . . 72.549999999999997 111.546 -177.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.69 67.23 0.57 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 121.404 -0.427 . . . . 71.120000000000005 113.312 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 m -122.13 143.2 38.44 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 112.069 0.396 . . . . 72.310000000000002 112.069 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.35 146.25 44.78 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.752 2.302 . . . . 74.140000000000001 112.597 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -54.89 -46.92 74.85 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.916 0.389 . . . . 61.130000000000003 111.967 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.07 -22.06 60.16 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.463 0.542 . . . . 74.510000000000005 112.463 -177.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.47 HG12 ' HG ' ' A' ' 57' ' ' LEU . 48.6 t -85.92 -6.45 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-O 121.085 0.469 . . . . 60.210000000000001 111.488 -178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.439 ' HD3' HD12 ' A' ' 76' ' ' ILE . 47.6 tpt85 -50.28 -44.42 53.83 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 111.984 0.365 . . . . 64.439999999999998 111.984 176.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -63.5 -40.72 97.82 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.494 -0.321 . . . . 72.430000000000007 111.326 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.24 -51.89 61.39 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.358 -0.383 . . . . 73.129999999999995 111.169 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.47 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.3 mt -53.16 -49.37 66.78 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.876 0.37 . . . . 74.299999999999997 111.811 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.75 -51.12 52.83 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.999 0.428 . . . . 44.039999999999999 111.822 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -58.43 -42.63 87.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.955 -0.566 . . . . 72.420000000000002 112.257 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.633 ' HG3' HH21 ' A' ' 63' ' ' ARG . 0.4 OUTLIER -70.43 -43.29 70.25 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.235 -0.439 . . . . 73.439999999999998 111.783 178.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.88 82.69 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.042 0.449 . . . . 74.420000000000002 111.314 176.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 45.1 mt-10 -61.66 -43.64 98.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.265 -0.425 . . . . 65.230000000000004 111.112 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.633 HH21 ' HG3' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -55.97 -44.16 78.25 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.883 0.373 . . . . 72.230000000000004 111.227 176.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 96.2 mt -60.32 -48.87 79.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.0 0.429 . . . . 73.329999999999998 111.09 176.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.59 -52.33 65.87 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.151 -0.477 . . . . 72.099999999999994 112.023 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.488 ' HB3' ' NZ ' ' A' ' 66' ' ' LYS . 7.7 mtpm? -61.63 -44.67 96.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 112.033 -177.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.0 -34.2 73.01 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 120.83 0.348 . . . . 51.310000000000002 111.898 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.1 7.76 36.37 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.259 0.466 . . . . 73.409999999999997 112.259 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 58.68 30.98 20.65 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.468 0.544 . . . . 74.019999999999996 112.468 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.6 pt -109.6 177.13 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.009 0.433 . . . . 64.530000000000001 111.728 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.433 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 55.4 p -102.62 153.4 20.14 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.119 0.485 . . . . 72.019999999999996 111.921 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -152.11 141.56 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.128 0.489 . . . . 74.349999999999994 111.628 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 74.4 p -118.55 141.21 48.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.253 -0.43 . . . . 54.43 110.079 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.409 ' HB2' ' HE3' ' A' ' 3' ' ' MET . 21.6 p90 -140.86 120.06 12.93 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.55 -0.296 . . . . 71.430000000000007 111.002 -176.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.0 m -153.58 116.71 4.56 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.446 0.535 . . . . 72.340000000000003 112.446 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 ' SD ' ' A' ' 3' ' ' MET . 29.1 mt -76.96 141.76 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.491 -0.322 . . . . 71.420000000000002 110.408 171.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.593 0 CA-C-O 122.066 0.936 . . . . 65.430000000000007 110.999 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttp . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.475 0.178 . . . . 74.530000000000001 110.553 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -124.38 164.08 20.41 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.971 0.415 . . . . 52.049999999999997 111.373 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt -148.43 118.84 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.789 0.328 . . . . 61.149999999999999 111.828 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 37.0 m-20 -94.81 104.77 16.68 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.779 0.324 . . . . 65.310000000000002 111.487 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.1 mt -105.12 146.45 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 122.33 0.252 . . . . 73.420000000000002 110.518 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.497 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 5.9 ptm180 -144.16 118.25 9.47 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.509 0.671 . . . . 75.239999999999995 111.882 175.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -90.41 149.88 22.08 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.774 -0.648 . . . . 64.319999999999993 110.331 174.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -141.74 120.38 12.55 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.701 0.286 . . . . 72.329999999999998 110.431 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.12 -164.83 36.21 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 121.065 -0.588 . . . . 53.130000000000003 113.143 -177.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -118.37 -24.48 6.85 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.21 0.448 . . . . 73.150000000000006 112.21 -176.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.9 118.32 6.55 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.562 . . . . 71.340000000000003 112.516 -173.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -67.59 -43.59 80.17 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.067 -0.515 . . . . 71.519999999999996 111.741 -178.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 3.5 mp0 -53.97 -30.63 47.78 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.0 0.371 . . . . 62.420000000000002 112.0 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.22 -40.36 70.75 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.488 -0.324 . . . . 61.100000000000001 111.713 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.474 ' O ' ' HB3' ' A' ' 19' ' ' LEU . 84.3 t80 -53.42 -57.23 11.37 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.306 -0.406 . . . . 71.420000000000002 111.429 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -65.38 -57.22 8.88 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.83 0.348 . . . . 74.239999999999995 111.625 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 72.8 mmtt -59.77 -47.34 86.07 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.383 0.512 . . . . 74.329999999999998 112.383 -170.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.429 ' HB1' HD13 ' A' ' 64' ' ' LEU . . . -75.0 -58.71 3.12 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.547 0.573 . . . . 62.119999999999997 112.547 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.474 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 67.7 tp -61.86 -53.29 57.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.194 0.442 . . . . 73.019999999999996 112.194 -173.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -60.56 -33.27 72.45 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.15 0.5 . . . . 74.140000000000001 110.755 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.503 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 16.1 tp10 -66.78 -44.2 81.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.33 0.652 . . . . 64.120000000000005 111.029 176.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.53 -44.61 90.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.994 0.425 . . . . 71.239999999999995 111.315 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.554 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.0 mt -61.15 -39.7 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.905 0.383 . . . . 75.549999999999997 110.782 175.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 52.3 ttt180 -49.38 -53.84 20.4 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.933 -0.576 . . . . 64.140000000000001 111.421 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.495 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 2.8 mp0 -61.04 -42.64 98.86 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.856 0.36 . . . . 64.340000000000003 111.273 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.37 -25.33 64.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.059 0.392 . . . . 74.439999999999998 112.059 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 3.9 mmp_? -77.96 -30.01 50.12 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.733 0.301 . . . . 74.430000000000007 111.529 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 25' ' ' GLN . 54.1 mtmt -75.21 -35.84 61.45 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.015 0.436 . . . . 73.329999999999998 110.863 175.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -90.4 -173.38 3.77 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.291 -0.413 . . . . 73.400000000000006 110.851 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.38 10.73 38.86 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.058 -0.401 . . . . 65.030000000000001 111.848 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -84.33 170.36 46.7 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 121.129 -0.558 . . . . 74.510000000000005 113.457 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 85.7 m -134.22 136.22 43.53 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.428 -0.454 . . . . 74.319999999999993 111.3 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 95.4 t -109.92 123.92 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.0 0.429 . . . . 73.230000000000004 111.973 -178.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 t -117.15 158.93 23.4 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.442 -0.345 . . . . 54.329999999999998 110.664 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -155.07 143.8 20.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.928 0.394 . . . . 54.539999999999999 112.035 -174.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -126.6 129.94 49.53 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.001 0.429 . . . . 65.409999999999997 111.419 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.439 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.0 mm? -89.68 133.62 34.56 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 111.069 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 12.1 t70 -138.3 81.02 1.83 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.349 -0.387 . . . . 72.400000000000006 110.488 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.51 -85.79 0.03 OUTLIER Glycine 0 CA--C 1.532 1.103 0 C-N-CA 121.428 -0.415 . . . . 72.140000000000001 113.634 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -117.0 9.43 13.68 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.989 0.423 . . . . 71.239999999999995 111.504 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 38' ' ' ASP . 5.8 m-20 -112.66 128.75 56.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.295 -0.411 . . . . 74.310000000000002 111.553 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.46 95.61 5.04 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.112 0.482 . . . . 75.299999999999997 110.331 174.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.497 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 32.4 mt-10 -93.5 112.15 23.98 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.261 0.553 . . . . 74.010000000000005 111.576 -176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.9 mt -109.38 111.73 37.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-N 115.752 -0.658 . . . . 72.510000000000005 111.988 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.491 HH12 ' HD2' ' A' ' 77' ' ' ARG . 51.4 ttt85 -101.85 128.18 48.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.903 0.383 . . . . 74.349999999999994 111.315 178.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 49.3 mt -111.29 130.73 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 121.128 0.489 . . . . 74.25 111.586 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.7 m -121.08 141.01 51.19 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.246 -0.434 . . . . 63.039999999999999 111.533 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.23 46.16 5.09 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 121.247 -0.501 . . . . 51.140000000000001 113.59 177.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.8 m -125.31 139.23 33.34 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.539 -0.389 . . . . 70.549999999999997 111.539 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.42 168.86 16.13 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.807 2.338 . . . . 73.349999999999994 113.033 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.52 -48.63 74.36 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.57 0.581 . . . . 71.299999999999997 112.57 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.435 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.8 pt20 -59.72 -42.45 93.14 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.386 0.513 . . . . 71.25 112.386 -176.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 52' ' ' GLN . 90.0 t -76.97 -30.91 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 120.686 0.279 . . . . 74.349999999999994 111.496 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.85 -46.0 78.3 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.663 0.268 . . . . 75.319999999999993 110.576 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -57.16 -43.25 82.37 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.018 0.437 . . . . 71.209999999999994 111.304 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.02 -40.55 96.59 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 111.293 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.91 -41.73 97.6 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.402 -0.363 . . . . 62.020000000000003 111.171 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.29 88.41 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.123 0.487 . . . . 71.420000000000002 111.217 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -55.61 -38.2 69.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.707 -0.679 . . . . 64.219999999999999 111.029 177.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.506 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 8.9 tp10 -70.35 -52.22 24.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.02 -0.536 . . . . 71.329999999999998 110.841 176.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.487 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -52.35 -51.44 58.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.765 0.654 . . . . 72.439999999999998 112.765 -176.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.47 -37.09 72.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.958 0.408 . . . . 75.430000000000007 111.416 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -39.28 68.98 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.344 -0.389 . . . . 62.130000000000003 111.394 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 94.4 mt -56.84 -45.51 82.32 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.999 0.428 . . . . 52.520000000000003 111.184 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -64.2 -50.71 67.02 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.148 -0.478 . . . . 54.509999999999998 111.478 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.55 ' HB3' ' NZ ' ' A' ' 66' ' ' LYS . 3.3 mmmp? -52.14 -44.3 64.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.119 -0.492 . . . . 74.239999999999995 112.193 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.15 -24.41 67.15 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.123 0.416 . . . . 75.209999999999994 112.123 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -114.86 10.75 16.5 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.761 0.315 . . . . 55.240000000000002 111.757 176.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m120 62.03 16.06 7.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.992 0.738 . . . . 64.530000000000001 112.992 177.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.434 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 30.4 pt -92.27 165.71 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-O 121.107 0.48 . . . . 73.099999999999994 111.953 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.4 m -89.57 148.4 23.39 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.342 -0.39 . . . . 75.439999999999998 111.338 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.26 134.49 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.099 0.476 . . . . 52.43 111.745 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.2 p -131.6 155.75 46.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.164 -0.471 . . . . 71.409999999999997 110.066 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -146.07 128.87 16.29 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.45 0.643 . . . . 62.140000000000001 112.624 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.3 m -100.55 136.13 40.91 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.732 -0.667 . . . . 64.049999999999997 110.615 176.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.2 mm -102.21 135.62 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.644 0.259 . . . . 72.049999999999997 111.307 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HD2' HH12 ' A' ' 45' ' ' ARG . 7.9 ptp180 . . . . . 0 N--CA 1.47 0.547 0 CA-C-O 121.304 0.573 . . . . 72.439999999999998 111.555 175.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttp . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.905 0.383 . . . . 73.120000000000005 111.427 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.458 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 35.7 mt-10 -84.86 169.55 14.01 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.646 0.26 . . . . 64.25 110.747 174.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.506 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 23.9 ttt -127.41 107.23 9.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.693 0.282 . . . . 65.140000000000001 111.585 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.567 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 5.1 m-20 -93.38 128.28 39.36 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.078 -0.51 . . . . 60.32 111.268 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.6 mt -136.57 146.29 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.403 0.281 . . . . 50.009999999999998 111.054 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.442 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 98.3 mtt180 -131.69 110.4 10.87 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 122.081 -0.387 . . . . 75.010000000000005 111.676 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -89.75 131.93 35.46 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.085 -0.507 . . . . 75.530000000000001 110.999 176.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -135.34 129.13 32.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.351 -0.218 . . . . 75.109999999999999 110.552 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.85 -158.22 9.56 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 120.462 -0.875 . . . . 43.43 114.394 -176.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.28 13.94 19.21 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.761 0.652 . . . . 53.100000000000001 112.761 -175.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -143.9 150.28 38.17 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.24 0.543 . . . . 64.109999999999999 112.395 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.0 tp -77.02 -57.83 3.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.583 -0.735 . . . . 74.019999999999996 111.579 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 33.1 mt-10 -62.9 -27.14 69.16 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.122 0.416 . . . . 71.129999999999995 112.122 -176.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.7 68.74 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.874 0.369 . . . . 64.329999999999998 110.942 174.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.433 ' HB3' HD22 ' A' ' 42' ' ' LEU . 25.1 m-85 -64.02 -41.55 97.41 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.115 0.483 . . . . 72.230000000000004 110.821 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.69 -33.16 74.35 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.81 -0.632 . . . . 42.009999999999998 111.497 -177.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 11.0 mmpt? -64.37 -52.77 56.62 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.214 0.53 . . . . 75.120000000000005 110.246 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.49 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.8 -46.73 86.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.832 -0.622 . . . . 73.329999999999998 111.188 177.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -55.52 -47.21 76.61 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.844 -0.616 . . . . 64.230000000000004 111.436 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -60.53 -43.85 96.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.233 -0.439 . . . . 63.32 111.488 -177.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.56 -42.74 98.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.438 -0.346 . . . . 73.430000000000007 111.659 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.439 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 94.8 mmm -62.32 -44.37 96.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.673 -0.239 . . . . 75.299999999999997 111.364 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 74.8 mt -64.53 -45.84 94.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 120.784 0.326 . . . . 74.209999999999994 111.089 176.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.9 ttp85 -54.29 -43.97 71.53 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.111 0.481 . . . . 53.439999999999998 111.332 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -74.07 -39.84 63.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.163 -0.472 . . . . 74.430000000000007 111.739 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . 0.46 ' HA ' ' HD2' ' A' ' 29' ' ' PHE . . . -59.76 -29.69 68.34 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.342 0.497 . . . . 60.539999999999999 112.342 -177.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.8 mtp180 -56.81 -28.38 61.4 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.11 0.411 . . . . 64.420000000000002 112.11 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.2 -26.98 67.64 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 111.958 0.355 . . . . 75.120000000000005 111.958 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.46 ' HD2' ' HA ' ' A' ' 26' ' ' ALA . 44.9 m-85 -92.77 142.91 26.82 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 75.040000000000006 111.646 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.67 77.5 6.28 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.159 0.504 . . . . 41.240000000000002 110.941 176.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -154.47 -155.99 7.5 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 120.886 -0.673 . . . . 41.32 113.934 -177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -128.57 139.72 52.15 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 122.648 -0.325 . . . . 71.420000000000002 111.408 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -114.61 130.29 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.794 0.331 . . . . 75.319999999999993 111.303 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 t -145.29 154.24 42.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.798 0.332 . . . . 61.409999999999997 111.679 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -156.38 161.79 40.1 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.108 0.48 . . . . 74.510000000000005 112.162 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.7 t -137.36 141.89 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.117 -0.492 . . . . 52.420000000000002 110.765 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.9 tp -121.39 128.33 52.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.949 0.404 . . . . 75.230000000000004 111.832 -176.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -127.63 84.67 2.27 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.144 0.497 . . . . 64.120000000000005 110.386 173.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.04 -101.0 0.38 Allowed Glycine 0 CA--C 1.528 0.868 0 CA-C-N 115.66 -0.7 . . . . 64.019999999999996 114.258 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -94.89 11.46 31.64 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.786 0.662 . . . . 73.239999999999995 112.786 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -145.04 133.38 21.75 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.968 0.413 . . . . 72.329999999999998 111.522 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.433 HD22 ' HB3' ' A' ' 15' ' ' PHE . 65.5 tp -122.35 117.39 25.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.399 . . . . 74.450000000000003 111.902 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -94.6 118.6 31.95 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.863 0.363 . . . . 71.409999999999997 111.253 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 46.5 mt -118.59 126.68 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.735 0.414 . . . . 75.439999999999998 110.761 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 3' ' ' MET . 39.9 ttp180 -125.15 121.09 33.19 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.952 0.405 . . . . 74.510000000000005 111.566 177.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.43 119.56 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.114 0.483 . . . . 73.510000000000005 110.843 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.458 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 59.2 m -92.35 112.49 24.46 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.946 -0.57 . . . . 74.010000000000005 111.913 -176.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.5 68.96 0.86 Allowed Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.241 -0.504 . . . . 62.210000000000001 113.571 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -126.3 130.32 23.96 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 120.799 0.333 . . . . 51.420000000000002 111.477 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.49 155.41 31.96 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.041 2.494 . . . . 74.010000000000005 114.153 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -66.67 -41.68 87.77 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.823 -0.626 . . . . 71.25 112.437 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.485 ' HG3' HG23 ' A' ' 53' ' ' VAL . 11.4 pt20 -59.23 -26.63 65.04 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.132 0.419 . . . . 70.129999999999995 112.132 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.485 HG23 ' HG3' ' A' ' 52' ' ' GLN . 38.3 t -98.4 -5.38 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-O 120.992 0.425 . . . . 70.310000000000002 111.642 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.506 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 18.1 tpp180 -53.07 -40.7 64.23 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 122.214 -0.303 . . . . 71.120000000000005 111.048 178.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -50.93 -50.78 57.03 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.179 0.514 . . . . 71.409999999999997 111.5 177.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -66.73 -54.26 24.7 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.657 -0.701 . . . . 64.209999999999994 111.486 -176.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.97 -46.97 81.82 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.052 -0.522 . . . . 71.519999999999996 111.905 -178.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.93 76.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.876 0.369 . . . . 65.230000000000004 111.606 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -76.19 -36.42 58.65 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.908 0.385 . . . . 72.120000000000005 111.323 -179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -63.65 -45.37 90.5 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.921 0.391 . . . . 73.430000000000007 111.294 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -60.38 -35.3 75.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.385 -0.37 . . . . 43.420000000000002 111.575 177.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 23.0 mm-40 -55.23 -49.29 72.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.845 0.355 . . . . 63.049999999999997 110.15 172.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 20.9 ttm-85 -56.06 -53.22 59.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.11 -0.495 . . . . 71.310000000000002 110.594 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 61' ' ' ALA . 88.5 mt -48.8 -46.85 42.3 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.714 -0.675 . . . . 71.519999999999996 112.18 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.18 88.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.31 -0.405 . . . . 73.510000000000005 111.781 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 32.2 mmtp -72.36 -35.12 68.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.506 0.558 . . . . 72.430000000000007 112.506 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 13.6 mm-40 -54.27 -41.42 68.83 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.051 0.453 . . . . 74.209999999999994 111.353 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -103.37 1.43 32.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.335 -0.393 . . . . 71.099999999999994 111.498 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.1 m120 54.24 42.32 31.56 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.488 0.661 . . . . 54.109999999999999 111.591 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 35.3 pt -103.74 169.3 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.589 -0.732 . . . . 72.049999999999997 111.308 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.6 m -87.71 148.97 24.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.64 0.257 . . . . 62.509999999999998 111.645 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.27 136.17 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.105 0.479 . . . . 73.409999999999997 112.051 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 73.6 p -118.22 146.47 44.22 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.429 -0.351 . . . . 72.200000000000003 111.179 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -122.93 137.65 54.89 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.117 0.484 . . . . 75.420000000000002 112.225 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 97.6 m -136.34 105.44 5.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.012 -0.54 . . . . 55.240000000000002 109.972 173.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.405 ' CD1' ' HG3' ' A' ' 3' ' ' MET . 42.7 mm -101.29 105.48 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 122.26 -0.275 . . . . 64.510000000000005 110.987 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 18.3 ptp180 . . . . . 0 CA--C 1.544 0.713 0 CA-C-O 121.629 0.728 . . . . 65.230000000000004 111.249 -178.591 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.419 ' C ' HH22 ' A' ' 54' ' ' ARG . 47.3 ttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.658 0.266 . . . . 74.25 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -117.27 155.74 28.96 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.01 0.374 . . . . 72.409999999999997 112.01 -172.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.631 ' HB3' ' NH1' ' A' ' 54' ' ' ARG . 21.8 ptm -149.59 142.36 24.64 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.338 0.495 . . . . 75.040000000000006 112.338 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -112.67 118.36 34.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 122.602 0.361 . . . . 72.129999999999995 111.518 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.1 mt -115.96 114.54 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 120.612 0.244 . . . . 71.010000000000005 110.862 175.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.456 ' HD2' ' N ' ' A' ' 6' ' ' ARG . 3.5 mpt_? -109.02 121.59 45.46 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.938 0.399 . . . . 75.040000000000006 111.809 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.571 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 88.4 m-85 -94.34 150.18 20.53 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.258 -0.428 . . . . 73.540000000000006 110.922 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 17.2 tpt180 -142.39 120.42 12.1 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.276 -0.42 . . . . 65.120000000000005 110.878 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.544 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -178.59 -179.35 48.41 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.978 -0.63 . . . . 71.129999999999995 113.108 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -108.49 -17.47 13.97 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.517 0.562 . . . . 61.329999999999998 112.517 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.38 110.18 7.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.027 0.441 . . . . 71.010000000000005 110.898 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 50.6 tp -62.38 -41.73 98.86 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.232 0.456 . . . . 65.310000000000002 112.232 -175.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -66.37 -35.03 79.31 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.577 0.227 . . . . 61.100000000000001 111.51 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.6 70.86 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.464 -0.334 . . . . 73.230000000000004 111.691 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -56.18 -51.77 66.82 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.651 -0.249 . . . . 74.329999999999998 111.403 177.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.26 -45.24 85.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.736 0.303 . . . . 71.450000000000003 111.439 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -57.83 -38.77 76.19 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.805 0.336 . . . . 72.120000000000005 111.804 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.551 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -73.96 -53.14 10.75 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.407 0.623 . . . . 73.239999999999995 111.234 177.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -60.07 -46.1 90.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.628 -0.715 . . . . 65.140000000000001 112.525 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -58.6 -40.0 81.99 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.776 0.43 . . . . 75.319999999999993 111.646 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -73.58 -38.83 65.04 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.889 0.376 . . . . 75.030000000000001 111.198 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 97.1 mmm -58.27 -46.58 85.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.066 0.46 . . . . 74.25 110.452 174.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 69.0 mt -64.63 -39.36 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.048 -0.524 . . . . 65.329999999999998 111.004 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 8.9 tpt180 -53.62 -50.11 66.39 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.855 0.36 . . . . 74.150000000000006 111.044 177.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -67.1 -48.78 67.12 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.397 -0.365 . . . . 61.210000000000001 111.13 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.84 -34.08 67.42 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.685 0.624 . . . . 71.129999999999995 112.685 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -59.21 -27.74 66.0 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.024 0.379 . . . . 75.409999999999997 112.024 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -76.62 -18.26 58.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.816 0.341 . . . . 62.149999999999999 111.875 178.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -108.33 143.79 36.74 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.079 0.466 . . . . 74.400000000000006 111.679 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.3 89.6 5.52 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.077 0.465 . . . . 71.319999999999993 111.759 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -155.97 -155.53 7.42 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.246 -0.502 . . . . 73.120000000000005 112.975 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.3 m -137.73 131.29 31.1 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.519 -0.401 . . . . 63.119999999999997 111.258 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.437 HG22 HG23 ' A' ' 46' ' ' ILE . 88.8 t -124.81 118.62 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.844 0.355 . . . . 74.340000000000003 111.264 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 45' ' ' ARG . 30.3 p -107.41 129.76 54.89 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.531 -0.304 . . . . 71.219999999999999 111.007 179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 52.7 p90 -133.0 142.74 49.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.349 0.5 . . . . 64.120000000000005 112.349 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 64.8 p -133.21 137.99 46.35 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.124 -0.489 . . . . 73.129999999999995 111.456 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.24 134.46 53.76 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.252 -0.431 . . . . 74.209999999999994 110.935 177.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -149.95 95.93 2.37 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.955 0.407 . . . . 42.509999999999998 111.396 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.66 -82.26 0.05 OUTLIER Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.263 -0.494 . . . . 75.340000000000003 113.532 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 13.0 m120 -122.47 -3.65 8.85 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 122.489 -0.419 . . . . 75.010000000000005 112.014 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -101.95 134.99 44.29 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.992 0.425 . . . . 70.430000000000007 111.822 -177.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 22.9 tp -128.91 99.96 5.49 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.022 -0.536 . . . . 74.25 110.366 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 46.0 mt-10 -91.92 104.48 16.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 75.409999999999997 111.326 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.6 mt -102.14 128.8 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.223 -0.444 . . . . 65.349999999999994 110.409 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB3' ' OG1' ' A' ' 34' ' ' THR . 51.1 ttt180 -126.16 112.57 15.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.93 0.395 . . . . 72.140000000000001 110.475 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.437 HG23 HG22 ' A' ' 33' ' ' VAL . 52.7 mt -104.85 114.47 44.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-O 121.246 0.546 . . . . 73.200000000000003 111.531 -176.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.6 m -105.14 113.82 27.65 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.848 -0.615 . . . . 63.509999999999998 111.769 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.3 -43.54 1.28 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 120.599 -0.81 . . . . 62.100000000000001 114.515 174.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.57 HG23 HH21 ' A' ' 54' ' ' ARG . 17.6 m -50.7 128.8 26.89 Favored Pre-proline 0 N--CA 1.478 0.969 0 N-CA-C 113.833 1.049 . . . . 65.25 113.833 -172.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -85.42 -169.26 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.772 2.981 . . . . 75.019999999999996 114.277 -177.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -48.45 -72.02 0.06 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.582 0.956 . . . . 75.239999999999995 113.582 -176.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.472 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 24.2 pt20 -50.11 -34.41 21.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.754 0.65 . . . . 64.349999999999994 112.754 -174.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 t -80.23 -36.02 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 120.989 0.423 . . . . 60.549999999999997 111.447 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB3' ' A' ' 3' ' ' MET . 4.5 tpp180 -53.77 -52.78 59.11 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.85 -0.614 . . . . 74.209999999999994 112.016 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . 0.472 ' HE3' ' HA ' ' A' ' 52' ' ' GLN . 22.2 pttp -61.67 -34.68 76.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.091 -0.504 . . . . 54.439999999999998 111.951 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -71.53 -42.51 67.85 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.66 0.267 . . . . 74.150000000000006 111.617 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.436 HD11 HG11 ' A' ' 49' ' ' VAL . 86.6 mt -64.45 -45.35 87.84 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.945 0.402 . . . . 73.519999999999996 111.183 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.29 96.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.171 0.51 . . . . 71.299999999999997 111.203 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -63.77 -35.43 80.58 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.043 -0.526 . . . . 73.310000000000002 111.593 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -67.12 -42.56 84.3 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.915 0.388 . . . . 71.349999999999994 110.998 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.558 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -52.17 -40.84 62.02 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.082 -0.508 . . . . 65.400000000000006 112.058 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 35.0 mm-40 -61.74 -50.55 71.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.727 0.298 . . . . 72.150000000000006 111.682 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -55.45 -51.7 66.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.94 0.4 . . . . 74.049999999999997 111.101 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.551 HD22 ' HA ' ' A' ' 18' ' ' ALA . 83.4 mt -55.39 -41.28 72.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.745 -0.661 . . . . 32.109999999999999 111.465 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.533 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -64.68 -50.96 64.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.178 0.513 . . . . 34.5 112.256 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 10.5 mmpt? -63.19 -60.54 3.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.096 0.776 . . . . 61.340000000000003 113.096 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -75.44 -15.77 60.4 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.962 0.727 . . . . 72.150000000000006 112.962 -172.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' A' ' 64' ' ' LEU . 84.9 m-85 -100.6 8.57 43.34 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 122.079 -0.388 . . . . 72.310000000000002 111.973 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 60.46 35.75 20.28 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.584 0.587 . . . . 75.329999999999998 112.584 173.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.544 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.6 pt -126.06 149.38 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 121.184 0.516 . . . . 64.329999999999998 111.639 179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.7 m -86.97 139.59 30.44 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.403 -0.362 . . . . 62.229999999999997 110.735 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.558 HG21 ' HB1' ' A' ' 61' ' ' ALA . 14.5 p -126.22 122.1 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.547 0.689 . . . . 63.420000000000002 112.414 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 80.9 p -121.18 121.7 38.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.788 -0.642 . . . . 73.109999999999999 110.449 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -122.05 143.09 49.71 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.869 0.692 . . . . 75.439999999999998 112.869 -175.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 94.4 m -122.54 120.26 33.29 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.567 -0.742 . . . . 75.049999999999997 110.612 178.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -118.79 144.86 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.959 0.409 . . . . 70.299999999999997 111.451 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 77' ' ' ARG . 59.3 mmt-85 . . . . . 0 CA--C 1.534 0.362 0 CA-C-O 121.023 0.44 . . . . 74.319999999999993 111.513 175.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.643 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 49.4 ttp . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.044 0.45 . . . . 70.109999999999999 111.51 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.664 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 27.3 mt-10 -127.42 170.8 12.15 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.115 -0.493 . . . . 73.099999999999994 110.774 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.658 ' SD ' ' NH2' ' A' ' 54' ' ' ARG . 27.5 ttt -143.69 128.0 17.78 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.649 0.611 . . . . 65.209999999999994 112.649 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 6' ' ' ARG . 4.7 m-20 -82.72 128.86 34.77 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.665 -0.698 . . . . 54.350000000000001 110.222 171.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.7 mt -139.56 109.42 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.77 0.319 . . . . 74.549999999999997 111.146 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 43' ' ' GLU . 2.4 mpt_? -119.45 125.41 48.87 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 122.104 -0.373 . . . . 65.129999999999995 111.975 -179.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -109.11 145.56 35.49 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 116.26 -0.427 . . . . 73.0 111.498 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -142.5 120.09 11.77 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.316 -0.253 . . . . 73.5 110.316 172.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -148.73 159.68 28.12 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.649 -0.786 . . . . 52.399999999999999 113.693 -176.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.98 -13.02 34.17 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.148 0.425 . . . . 73.530000000000001 112.148 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.27 161.08 25.3 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.039 0.447 . . . . 65.310000000000002 111.933 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.3 tp -85.51 -58.51 2.64 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.948 0.404 . . . . 75.239999999999995 111.674 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 41.4 mt-10 -66.78 -30.25 70.41 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 111.979 0.363 . . . . 62.310000000000002 111.979 -175.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.2 -33.17 51.64 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.997 0.369 . . . . 64.010000000000005 111.997 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.425 ' CE1' HD11 ' A' ' 37' ' ' LEU . 77.4 t80 -59.68 -53.56 56.64 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.109 0.481 . . . . 72.430000000000007 111.213 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -73.78 -36.9 65.11 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.016 -0.538 . . . . 74.400000000000006 111.906 -176.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 75.2 mmtt -59.59 -54.21 49.12 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.948 0.404 . . . . 63.340000000000003 111.306 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.48 -47.76 84.74 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.255 -0.43 . . . . 70.439999999999998 111.724 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.32 -45.44 91.32 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.026 0.441 . . . . 64.209999999999994 111.55 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -64.07 -42.91 96.83 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.303 -0.408 . . . . 62.329999999999998 111.653 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -61.8 -46.51 89.23 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.103 0.408 . . . . 73.530000000000001 112.103 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 78.2 mmm -56.52 -44.8 81.14 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.845 0.355 . . . . 75.540000000000006 111.196 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.9 mt -66.13 -43.43 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 121.054 0.454 . . . . 71.530000000000001 110.936 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -53.02 -54.68 31.77 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.229 0.612 . . . . 73.329999999999998 112.017 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.07 -37.75 84.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.774 0.321 . . . . 73.010000000000005 111.512 176.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.24 -25.24 65.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.222 0.452 . . . . 71.409999999999997 112.222 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 11.8 mmm180 -56.59 -27.79 58.8 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.142 0.423 . . . . 65.140000000000001 112.142 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.429 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -61.96 -25.56 67.68 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 111.788 0.292 . . . . 72.129999999999995 111.788 178.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.444 ' CZ ' HG21 ' A' ' 53' ' ' VAL . 23.4 m-85 -118.06 171.73 7.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.449 0.642 . . . . 72.299999999999997 112.074 -173.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.16 90.52 3.96 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.047 -0.524 . . . . 75.030000000000001 110.574 173.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -152.17 164.7 30.58 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 120.975 -0.631 . . . . 52.0 113.355 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -95.95 123.26 39.47 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.777 0.322 . . . . 73.530000000000001 111.594 -177.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t -115.31 119.35 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 116.255 -0.429 . . . . 71.400000000000006 110.552 175.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -130.87 164.48 25.14 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.701 0.286 . . . . 64.540000000000006 111.426 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.9 p90 -155.23 146.97 23.25 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.007 0.432 . . . . 73.549999999999997 111.683 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . 0.557 HG23 ' HB3' ' A' ' 43' ' ' GLU . 0.7 OUTLIER -137.32 137.38 38.88 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.886 0.374 . . . . 74.140000000000001 111.406 178.395 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.425 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.4 130.47 34.64 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.914 0.388 . . . . 60.420000000000002 111.568 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.58 106.32 7.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.992 0.425 . . . . 75.150000000000006 110.878 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.47 -97.0 0.22 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 121.229 -0.51 . . . . 54.329999999999998 113.335 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -125.29 11.14 8.08 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.132 0.419 . . . . 63.399999999999999 112.132 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -132.67 158.96 40.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.353 0.597 . . . . 64.150000000000006 112.407 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 35' ' ' TYR . 64.0 tp -109.08 125.29 51.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.778 -0.647 . . . . 74.140000000000001 111.604 -177.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.696 ' HA ' ' HG3' ' A' ' 6' ' ' ARG . 1.5 tm-20 -101.87 108.37 19.82 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 110.471 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -108.6 139.78 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.08 0.466 . . . . 73.230000000000004 112.245 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -125.28 123.28 39.13 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.072 -0.513 . . . . 74.439999999999998 110.763 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.59 121.83 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.819 0.343 . . . . 73.439999999999998 111.45 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.531 HG23 ' HG2' ' A' ' 2' ' ' GLU . 86.2 m -121.86 126.74 49.41 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 111.601 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.15 55.32 0.51 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.238 -0.506 . . . . 52.020000000000003 113.941 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 24.7 m -133.58 144.37 51.82 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.356 -0.497 . . . . 74.25 111.783 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.83 162.83 10.53 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.909 2.406 . . . . 72.400000000000006 113.598 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.55 -37.06 84.64 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.361 0.504 . . . . 74.409999999999997 112.361 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -60.3 -18.53 50.07 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.736 0.643 . . . . 74.120000000000005 112.736 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.54 HG12 ' HG ' ' A' ' 57' ' ' LEU . 16.4 t -112.42 -2.68 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.397 0.617 . . . . 62.329999999999998 111.066 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.658 ' NH2' ' SD ' ' A' ' 3' ' ' MET . 5.3 tpm_? -52.59 -58.38 6.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.87 -0.604 . . . . 65.540000000000006 112.525 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -66.05 -33.34 75.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.036 -0.529 . . . . 74.150000000000006 111.625 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.85 -50.56 70.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.21 -0.45 . . . . 72.430000000000007 111.235 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HG ' HG12 ' A' ' 53' ' ' VAL . 98.7 mt -61.36 -38.48 87.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.931 0.396 . . . . 61.530000000000001 111.206 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.26 98.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 111.678 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 62' ' ' GLU . 22.0 ttmm -78.51 -32.73 48.26 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 120.903 0.383 . . . . 53.329999999999998 111.954 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ARG . 29.1 tt0 -64.16 -32.87 74.61 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.952 -0.467 . . . . 72.109999999999999 110.555 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.4 -38.41 74.25 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.372 -0.377 . . . . 73.150000000000006 110.845 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 43.5 mt-10 -59.64 -43.72 93.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.979 0.419 . . . . 72.129999999999995 110.574 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 33.8 ttm180 -54.95 -54.0 48.38 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.28 -0.418 . . . . 71.140000000000001 111.347 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 18' ' ' ALA . 93.5 mt -56.42 -39.19 72.65 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 75.319999999999993 111.687 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.14 -57.13 4.51 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.069 0.461 . . . . 73.230000000000004 111.938 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.82 -24.86 66.22 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.52 . . . . 74.230000000000004 112.403 -174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -61.18 -47.92 83.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.116 0.484 . . . . 72.450000000000003 110.587 179.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -104.27 8.68 36.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.152 -0.476 . . . . 62.210000000000001 111.396 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 60.96 24.92 14.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.494 0.553 . . . . 74.019999999999996 112.494 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.2 pt -87.77 166.43 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.006 0.431 . . . . 75.510000000000005 111.673 -177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.2 m -87.54 142.5 27.8 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.48 -0.327 . . . . 72.299999999999997 111.366 -178.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 14.6 p -143.62 134.97 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.135 0.493 . . . . 62.520000000000003 111.839 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -119.43 123.09 43.22 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.697 -0.483 . . . . 74.540000000000006 109.697 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 34.0 p90 -128.46 135.32 49.3 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.232 0.539 . . . . 65.510000000000005 111.829 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.405 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 86.6 m -133.39 148.55 51.82 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.888 -0.596 . . . . 61.240000000000002 110.781 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.9 mm -101.99 114.28 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.907 0.384 . . . . 74.120000000000005 111.196 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 13.7 mtp180 . . . . . 0 CA--C 1.536 0.432 0 N-CA-C 112.177 0.436 . . . . 74.109999999999999 112.177 180.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 tmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.806 -0.442 . . . . 73.129999999999995 109.806 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -102.58 148.72 25.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.926 0.394 . . . . 73.319999999999993 111.469 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.7 ttt -124.36 124.44 42.37 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.146 0.498 . . . . 61.109999999999999 112.123 -176.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -106.12 115.34 30.06 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.967 -0.56 . . . . 64.239999999999995 110.798 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.2 mt -120.72 141.69 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.42 0.288 . . . . 63.409999999999997 111.089 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.473 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 26.4 mtm105 -144.37 122.63 12.26 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.153 0.427 . . . . 70.310000000000002 112.153 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 41' ' ' ASP . 95.8 m-85 -103.13 125.43 49.83 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.473 -0.33 . . . . 70.400000000000006 111.628 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.509 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 8.2 tpt180 -104.33 119.33 38.73 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.813 0.34 . . . . 75.239999999999995 110.616 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.43 146.63 9.64 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 121.235 -0.507 . . . . 74.430000000000007 113.029 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -94.28 3.07 55.73 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 122.461 -0.434 . . . . 62.219999999999999 112.111 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.08 134.27 37.75 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.089 0.471 . . . . 71.420000000000002 111.991 177.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -71.3 -52.76 17.07 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.218 -0.446 . . . . 44.299999999999997 111.606 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.29 -31.2 67.26 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.783 0.325 . . . . 65.209999999999994 111.792 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.97 -40.14 69.73 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.518 -0.31 . . . . 73.439999999999998 111.69 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -56.64 -54.26 48.1 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.904 0.383 . . . . 64.439999999999998 111.333 176.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.02 -49.95 70.38 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.355 -0.384 . . . . 71.439999999999998 111.765 -178.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 70.3 mmtt -61.87 -54.57 40.29 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.331 0.493 . . . . 75.530000000000001 112.331 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.494 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -57.71 -48.55 79.24 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.82 0.343 . . . . 64.510000000000005 111.879 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.72 -44.68 92.87 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.856 0.36 . . . . 64.120000000000005 111.333 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -62.49 -46.01 90.39 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.966 0.358 . . . . 71.120000000000005 111.966 -177.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 25.7 mm-40 -64.82 -45.54 85.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.634 0.254 . . . . 75.140000000000001 111.557 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.6 mmt -55.8 -50.64 69.94 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.125 0.488 . . . . 72.530000000000001 111.017 176.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.559 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 64.9 mt -62.18 -42.47 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.269 -0.423 . . . . 73.450000000000003 111.429 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.7 ttm-85 -49.28 -48.12 46.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.108 0.48 . . . . 62.109999999999999 111.474 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -68.43 -46.08 70.84 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.939 -0.573 . . . . 75.420000000000002 111.829 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.37 -22.39 63.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.225 0.824 . . . . 52.32 113.225 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 37.1 mtp85 -56.68 -28.66 61.21 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 112.777 0.658 . . . . 65.150000000000006 112.777 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 0.4 OUTLIER -74.78 -20.95 59.58 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.969 0.359 . . . . 63.240000000000002 111.969 179.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -106.73 178.0 4.69 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.393 0.616 . . . . 62.130000000000003 112.181 -173.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -89.94 28.07 1.45 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.953 -0.567 . . . . 24.129999999999999 111.269 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.16 128.87 9.63 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 116.074 -0.512 . . . . 74.299999999999997 113.182 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 96.2 m -88.49 117.37 27.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.883 0.373 . . . . 73.430000000000007 111.026 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.495 HG22 HG12 ' A' ' 46' ' ' ILE . 77.1 t -103.41 109.79 28.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 120.996 0.427 . . . . 72.420000000000002 111.225 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.4 t -110.86 157.06 20.26 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.361 -0.381 . . . . 71.319999999999993 110.894 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.431 ' HB2' HD11 ' A' ' 42' ' ' LEU . 29.3 p90 -140.96 133.87 29.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.128 0.489 . . . . 75.120000000000005 112.1 -176.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 p -129.61 130.54 45.78 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.078 -0.51 . . . . 72.420000000000002 110.528 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -91.36 120.35 32.15 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.946 0.35 . . . . 52.539999999999999 111.946 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -113.25 88.97 2.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.941 0.4 . . . . 71.430000000000007 109.973 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.68 -101.2 0.23 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.167 -0.54 . . . . 70.319999999999993 113.558 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -109.03 13.21 24.76 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.584 -0.363 . . . . 62.210000000000001 111.669 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.465 ' HA ' ' O ' ' A' ' 7' ' ' PHE . 21.8 t70 -119.47 121.85 40.38 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.134 0.492 . . . . 74.420000000000002 110.654 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 35' ' ' TYR . 41.5 tp -94.47 106.84 18.83 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.194 -0.457 . . . . 73.209999999999994 110.897 178.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 6' ' ' ARG . 36.2 mt-10 -85.06 103.85 14.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.97 0.414 . . . . 70.299999999999997 111.068 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 113.2 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 120.984 0.421 . . . . 75.239999999999995 111.066 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -109.06 120.82 43.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.813 0.339 . . . . 64.420000000000002 111.154 -178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.495 HG12 HG22 ' A' ' 33' ' ' VAL . 53.4 mt -110.99 112.39 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 120.942 0.401 . . . . 74.430000000000007 111.214 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 73.0 m -107.01 132.49 52.88 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.186 0.439 . . . . 71.230000000000004 112.186 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.86 62.02 1.88 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.409 -0.424 . . . . 74.5 114.152 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 m -133.01 139.03 33.16 Favored Pre-proline 0 CA--C 1.545 0.773 0 O-C-N 122.481 -0.423 . . . . 52.409999999999997 111.944 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -58.05 132.61 50.44 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.738 2.292 . . . . 74.329999999999998 113.081 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -52.11 -36.4 50.94 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.076 0.769 . . . . 53.119999999999997 113.076 -174.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -67.2 -34.76 78.19 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 120.803 0.335 . . . . 73.450000000000003 111.871 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.2 t -75.21 -19.19 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 121.105 0.478 . . . . 62.399999999999999 111.185 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -50.6 -36.47 35.13 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.044 -0.526 . . . . 74.439999999999998 111.971 177.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -61.91 -43.08 99.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.702 -0.226 . . . . 73.329999999999998 111.496 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -64.61 -43.35 94.05 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.802 0.334 . . . . 72.340000000000003 111.121 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.8 -42.61 99.23 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.02 0.438 . . . . 74.420000000000002 111.05 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -67.87 -45.33 74.82 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 65.319999999999993 111.591 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -65.95 -32.82 74.53 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 75.129999999999995 111.427 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.59 -45.46 93.88 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.641 -0.503 . . . . 74.129999999999995 109.641 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.75 97.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.137 -0.483 . . . . 52.240000000000002 111.541 176.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-10 -55.54 -45.51 77.19 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.279 0.561 . . . . 74.010000000000005 110.533 175.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.407 ' HD3' HH11 ' A' ' 63' ' ' ARG . 9.8 tpt180 -64.98 -49.51 69.99 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.584 -0.735 . . . . 74.209999999999994 111.412 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.494 HD22 ' HA ' ' A' ' 18' ' ' ALA . 91.8 mt -54.43 -45.2 72.97 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.029 0.381 . . . . 73.519999999999996 112.029 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.27 -56.72 15.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.807 0.337 . . . . 74.519999999999996 111.724 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -61.85 -35.75 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.147 0.425 . . . . 75.319999999999993 112.147 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.74 -34.94 73.61 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.03 0.443 . . . . 71.420000000000002 111.243 -178.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -105.71 0.04 25.9 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.349 -0.387 . . . . 72.310000000000002 111.553 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 61.17 21.62 12.04 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.113 0.565 . . . . 71.430000000000007 112.078 -177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 33.2 pt -86.92 175.34 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.015 0.436 . . . . 65.219999999999999 111.239 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 22.8 m -93.54 146.42 23.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.738 0.304 . . . . 73.109999999999999 111.318 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.2 p -137.6 139.57 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.148 0.499 . . . . 33.130000000000003 111.518 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.9 p -132.49 143.13 49.55 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.086 -0.507 . . . . 72.319999999999993 110.097 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -147.57 134.13 19.82 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.213 0.53 . . . . 74.120000000000005 111.916 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.3 p -121.08 145.0 48.25 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.957 -0.565 . . . . 71.340000000000003 110.822 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.7 mm -117.26 144.78 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.626 -0.261 . . . . 75.540000000000006 110.945 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 . . . . . 0 N--CA 1.467 0.376 0 CA-C-O 121.234 0.54 . . . . 73.219999999999999 111.66 175.458 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.0 mtp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.14 0.495 . . . . 74.530000000000001 111.558 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -133.43 147.4 51.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.005 -0.543 . . . . 72.140000000000001 109.586 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.457 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 28.6 ttt -148.88 118.99 7.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.092 0.775 . . . . 72.400000000000006 113.092 -173.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 6.5 m-20 -87.97 119.39 28.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.445 -0.343 . . . . 62.109999999999999 110.38 172.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 51.2 mt -116.33 108.4 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.032 0.444 . . . . 71.209999999999994 111.064 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.426 ' HG2' ' HB2' ' A' ' 43' ' ' GLU . 61.8 mtm-85 -98.56 102.1 13.74 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.575 0.583 . . . . 74.200000000000003 112.575 -176.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -85.78 143.24 28.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.454 -0.339 . . . . 73.230000000000004 110.305 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 43.9 ttt180 -141.47 118.88 11.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.564 0.221 . . . . 73.329999999999998 110.599 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.96 153.19 24.65 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.194 -0.527 . . . . 63.109999999999999 113.136 -176.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -97.49 -14.27 21.22 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.045 0.757 . . . . 64.230000000000004 113.045 -174.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . 0.444 ' CG ' ' H ' ' A' ' 12' ' ' LEU . 7.2 p-10 -72.66 -91.13 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 112.87 0.693 . . . . 75.310000000000002 112.87 -174.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.444 ' H ' ' CG ' ' A' ' 11' ' ' ASP . 57.9 tp 171.14 -51.82 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.145 0.578 . . . . 74.549999999999997 110.04 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 48.7 mt-10 -62.39 -29.93 70.84 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.652 -0.704 . . . . 54.039999999999999 111.687 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.71 -39.67 62.27 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.817 0.342 . . . . 75.319999999999993 111.383 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -62.47 -60.53 3.42 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.928 0.394 . . . . 61.409999999999997 111.574 176.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -63.12 -50.51 70.2 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.499 0.555 . . . . 71.329999999999998 112.499 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 65.0 mmtt -67.02 -46.1 75.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 111.742 0.275 . . . . 74.310000000000002 111.742 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -63.96 -46.21 85.7 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.781 0.324 . . . . 74.120000000000005 111.369 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.03 -47.23 78.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.017 0.437 . . . . 64.340000000000003 110.566 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -52.07 -55.92 17.66 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.704 -0.68 . . . . 74.129999999999995 112.166 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.89 -42.5 97.44 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.157 0.429 . . . . 73.209999999999994 112.157 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.429 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 77.6 mmm -61.94 -45.16 94.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.636 0.255 . . . . 74.420000000000002 111.294 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 66.7 mt -60.36 -40.45 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.733 0.302 . . . . 75.299999999999997 110.634 175.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -56.6 -41.98 77.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.866 0.365 . . . . 73.420000000000002 111.041 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -69.28 -42.87 74.94 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.059 0.457 . . . . 72.450000000000003 111.183 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.82 -35.52 81.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.377 -0.374 . . . . 63.149999999999999 111.816 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 41.4 mtp85 -64.36 -28.88 70.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.189 0.44 . . . . 73.450000000000003 112.189 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -55.32 -43.39 74.87 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.285 0.564 . . . . 73.430000000000007 110.491 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -97.84 -6.15 33.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.773 -0.649 . . . . 74.219999999999999 111.838 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 60.17 42.83 14.84 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.053 0.454 . . . . 42.340000000000003 111.922 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -87.57 -175.96 48.45 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.268 -0.491 . . . . 72.340000000000003 113.784 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.6 m -94.76 131.45 40.58 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.649 0.38 . . . . 74.310000000000002 111.315 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.34 125.56 70.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 112.165 0.431 . . . . 62.310000000000002 112.165 -178.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -136.26 144.83 45.01 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.217 -0.447 . . . . 72.120000000000005 110.773 173.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 44.3 p90 -142.84 140.68 31.38 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.566 0.58 . . . . 73.109999999999999 112.566 -176.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 p -115.24 141.83 47.49 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 116.01 -0.541 . . . . 71.340000000000003 111.696 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -113.36 125.73 54.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.031 0.443 . . . . 74.430000000000007 112.067 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.47 96.35 2.97 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.29 -0.414 . . . . 73.209999999999994 110.346 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.89 -101.12 0.62 Allowed Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.993 -0.622 . . . . 61.219999999999999 112.862 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -110.04 3.93 20.81 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.973 0.416 . . . . 70.430000000000007 110.992 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -93.8 130.74 39.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.097 -0.502 . . . . 73.109999999999999 112.044 -175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.1 tp -131.68 101.55 5.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.097 -0.502 . . . . 74.409999999999997 110.955 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.5 tt0 -97.27 108.77 21.57 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.884 0.374 . . . . 75.010000000000005 111.116 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.8 mt -101.95 108.57 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.226 -0.443 . . . . 65.420000000000002 110.867 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -93.11 111.3 22.89 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.878 0.371 . . . . 61.420000000000002 110.684 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.7 mt -101.98 110.41 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.312 0.577 . . . . 65.239999999999995 110.734 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -97.84 130.44 44.75 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 72.239999999999995 111.154 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.05 -15.88 15.82 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 120.95 -0.643 . . . . 52.32 113.558 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.928 HG23 HH22 ' A' ' 54' ' ' ARG . 15.1 m -61.2 138.64 94.5 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-N 117.221 0.511 . . . . 73.109999999999999 112.086 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.62 -176.87 3.2 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.191 2.594 . . . . 61.240000000000002 114.286 -173.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 10.2 pt-20 -90.49 -50.48 5.92 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.581 0.585 . . . . 64.299999999999997 112.581 -176.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -64.11 -40.5 96.33 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.649 0.611 . . . . 70.439999999999998 112.649 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.415 ' O ' HG12 ' A' ' 53' ' ' VAL . 22.8 t -73.58 -3.33 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 CA-C-O 120.955 0.407 . . . . 75.299999999999997 111.847 -177.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.928 HH22 HG23 ' A' ' 49' ' ' VAL . 18.4 tpp180 -51.22 -35.39 36.53 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.127 0.417 . . . . 72.319999999999993 112.127 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -55.76 -53.59 54.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.255 0.55 . . . . 75.420000000000002 111.378 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -74.54 -32.86 62.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.158 -0.474 . . . . 70.420000000000002 111.864 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.3 mt -56.75 -43.66 80.97 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.114 0.483 . . . . 53.329999999999998 111.065 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.07 73.29 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.026 0.441 . . . . 74.109999999999999 111.109 175.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -56.52 -39.61 73.64 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.961 -0.563 . . . . 75.329999999999998 111.94 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -64.81 -48.22 75.19 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.908 0.385 . . . . 44.32 110.904 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.28 -43.9 88.21 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.155 -0.475 . . . . 61.25 111.264 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 49.5 mt-10 -60.96 -42.14 97.72 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.309 -0.405 . . . . 71.439999999999998 111.168 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 27.9 ttm180 -55.26 -54.9 37.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.69 0.281 . . . . 75.439999999999998 110.653 174.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.5 mt -52.63 -45.9 66.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.17 -0.468 . . . . 71.420000000000002 111.675 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.67 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.402 -0.363 . . . . 72.5 111.85 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 34.0 mmtp -72.3 -30.23 64.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.178 0.436 . . . . 65.150000000000006 112.178 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.7 mm-40 -61.9 -38.51 88.62 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 122.118 -0.364 . . . . 73.430000000000007 111.598 178.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -100.87 -5.89 25.48 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.862 0.319 . . . . 62.530000000000001 111.862 178.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 56.64 60.03 3.28 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.643 0.735 . . . . 75.400000000000006 110.551 -173.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 39.6 pt -125.39 -176.37 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 115.502 -0.772 . . . . 71.409999999999997 111.28 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.5 m -98.89 141.42 31.69 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.596 -0.275 . . . . 44.109999999999999 111.712 -177.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.1 p -142.03 129.26 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.449 0.642 . . . . 74.409999999999997 111.792 176.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -129.87 123.29 30.47 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 116.12 -0.491 . . . . 43.229999999999997 110.273 175.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.7 p90 -125.57 136.63 53.5 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.523 0.677 . . . . 74.439999999999998 112.734 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 64.9 m -103.56 123.16 46.43 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.512 -0.767 . . . . 62.32 110.936 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.669 HD12 ' HD2' ' A' ' 54' ' ' ARG . 42.4 mm -94.22 114.13 30.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.68 0.276 . . . . 75.230000000000004 111.67 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 . . . . . 0 CA--C 1.539 0.538 0 CA-C-O 120.952 0.406 . . . . 74.099999999999994 111.317 177.387 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' N ' ' A' ' 2' ' ' GLU . 6.3 tmm? . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 110.062 -0.347 . . . . 55.109999999999999 110.062 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.528 ' N ' ' SD ' ' A' ' 1' ' ' MET . 26.5 mt-10 -132.62 137.71 47.13 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.072 0.463 . . . . 72.430000000000007 111.788 -175.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.539 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.3 ttt -139.33 106.91 5.58 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.943 -0.571 . . . . 72.420000000000002 111.247 -170.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.482 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 16.0 m-20 -90.89 106.93 18.86 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.476 0.311 . . . . 62.450000000000003 111.39 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.9 mm -97.51 109.3 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.706 0.289 . . . . 75.340000000000003 111.208 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 2.5 ttp180 -118.67 116.35 26.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.325 0.583 . . . . 72.109999999999999 112.097 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -95.15 142.57 27.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.839 -0.618 . . . . 74.510000000000005 111.379 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -141.91 121.11 13.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 111.222 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.61 -165.22 36.47 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.964 -0.636 . . . . 35.219999999999999 113.311 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -123.66 102.13 7.67 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 122.48 -0.424 . . . . 60.229999999999997 111.867 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -176.82 141.86 0.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.051 -0.522 . . . . 75.340000000000003 110.416 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.1 tp -76.01 -44.48 39.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 111.97 0.359 . . . . 74.450000000000003 111.97 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 4.8 mp0 -73.97 -27.52 61.03 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 112.1 0.407 . . . . 53.43 112.1 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -47.59 68.12 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.193 0.812 . . . . 31.120000000000001 113.193 -173.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -60.95 -61.27 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.22 0.452 . . . . 65.439999999999998 112.22 -176.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.46 -39.38 91.93 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.597 0.591 . . . . 73.400000000000006 112.597 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 10.5 mmmt -65.83 -52.93 46.41 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.27 0.47 . . . . 62.310000000000002 112.27 -179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.8 88.19 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.294 0.568 . . . . 61.520000000000003 110.791 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 tp -63.26 -41.44 99.05 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.682 -0.69 . . . . 53.530000000000001 111.43 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -57.22 -48.46 78.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.157 -0.474 . . . . 65.530000000000001 111.935 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -60.61 -44.87 95.81 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.09 0.472 . . . . 74.319999999999993 111.384 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 96.3 mmm -61.53 -49.08 78.15 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.192 -0.458 . . . . 72.420000000000002 111.525 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.82 -37.68 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 120.741 0.305 . . . . 73.349999999999994 111.366 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -53.67 -47.9 69.96 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.892 0.377 . . . . 75.540000000000006 111.119 177.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.642 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 72.2 mm-40 -74.35 -40.16 62.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.322 -0.399 . . . . 64.239999999999995 111.276 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.13 -38.58 79.97 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.308 0.484 . . . . 50.329999999999998 112.308 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -59.92 -29.55 68.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.061 0.458 . . . . 72.349999999999994 111.466 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.642 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 50.7 mtpt -72.22 -13.81 61.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 111.759 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -110.46 -177.26 3.19 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.013 0.435 . . . . 70.319999999999993 111.167 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -96.93 -10.72 25.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.765 0.317 . . . . 54.43 111.746 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.34 150.61 51.95 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.488 -0.387 . . . . 74.109999999999999 113.76 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 144.52 27.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.028 0.442 . . . . 63.140000000000001 111.518 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.444 HG22 HG23 ' A' ' 46' ' ' ILE . 84.5 t -129.36 131.61 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.161 -0.472 . . . . 53.530000000000001 111.045 178.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -131.8 140.25 49.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.733 0.302 . . . . 45.100000000000001 110.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -131.8 151.48 51.64 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.291 0.478 . . . . 74.200000000000003 112.291 -174.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 t -137.26 131.68 32.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.062 -0.517 . . . . 65.549999999999997 111.33 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mm? -100.91 123.61 45.36 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.947 0.403 . . . . 75.340000000000003 111.271 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -121.7 83.86 2.16 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.26 0.552 . . . . 71.319999999999993 110.209 174.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.23 -101.2 0.3 Allowed Glycine 0 CA--C 1.528 0.857 0 CA-C-N 115.752 -0.658 . . . . 62.409999999999997 113.159 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -108.58 21.77 16.84 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.059 0.457 . . . . 55.109999999999999 111.437 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -127.94 140.5 51.96 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 116.087 -0.506 . . . . 73.109999999999999 110.377 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 31.7 tp -134.17 118.81 18.07 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.104 0.409 . . . . 74.329999999999998 112.104 -177.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -108.83 131.77 54.66 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.641 0.257 . . . . 72.200000000000003 110.743 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -127.11 109.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 120.88 0.372 . . . . 71.5 110.981 -179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 45' ' ' ARG . 15.2 ttp85 -92.48 108.54 20.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.002 0.429 . . . . 73.209999999999994 111.402 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.444 HG23 HG22 ' A' ' 33' ' ' VAL . 58.2 mt -102.74 136.63 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 116.11 -0.496 . . . . 52.450000000000003 111.369 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.8 m -144.04 121.77 11.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 122.24 -0.288 . . . . 63.140000000000001 111.386 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 133.04 -27.8 3.41 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 120.87 -0.681 . . . . 62.450000000000003 114.275 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.3 m -71.24 134.64 84.91 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 122.238 -0.566 . . . . 72.239999999999995 111.7 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.97 153.91 74.08 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.719 2.279 . . . . 64.209999999999994 113.512 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -56.73 -31.24 64.34 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.555 0.946 . . . . 62.409999999999997 113.555 -175.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -71.83 -33.88 68.84 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.411 0.523 . . . . 72.010000000000005 112.411 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -81.41 -30.12 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 121.186 0.517 . . . . 73.109999999999999 110.677 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.476 ' HE ' ' HB3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -49.09 -45.75 43.69 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.591 -0.731 . . . . 73.340000000000003 112.194 177.357 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -65.18 -31.03 72.0 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.865 0.364 . . . . 64.230000000000004 111.712 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -71.51 -44.67 64.24 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.091 0.472 . . . . 74.349999999999994 110.233 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.34 -35.78 81.52 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.045 -0.525 . . . . 72.450000000000003 111.15 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.38 -45.05 95.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.996 0.427 . . . . 74.019999999999996 111.247 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.2 -43.71 87.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.168 -0.469 . . . . 73.230000000000004 110.85 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.65 -42.23 86.97 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.132 -0.486 . . . . 74.5 111.191 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.79 -45.42 78.22 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.993 0.425 . . . . 71.200000000000003 111.418 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -64.99 -36.47 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.987 0.422 . . . . 72.239999999999995 111.034 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.421 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 9.9 tpp180 -59.49 -48.04 83.18 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.249 -0.432 . . . . 63.509999999999998 110.26 175.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.29 -43.6 74.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.695 -0.684 . . . . 75.019999999999996 111.627 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.56 75.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.185 0.517 . . . . 64.219999999999999 111.278 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.32 -38.01 86.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.966 -0.561 . . . . 72.450000000000003 111.409 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 8.1 mm-40 -53.27 -35.4 60.01 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.409 -0.36 . . . . 63.310000000000002 111.834 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -114.74 6.19 15.51 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.315 0.487 . . . . 73.329999999999998 112.315 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.542 HD22 ' N ' ' A' ' 69' ' ' ASN . 0.8 OUTLIER 60.83 24.97 14.89 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.844 0.354 . . . . 74.150000000000006 111.834 179.499 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -101.49 -179.51 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.902 0.382 . . . . 63.310000000000002 111.506 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 95.6 m -102.67 131.75 49.25 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.8 0.333 . . . . 74.409999999999997 111.778 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -111.09 134.2 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.261 0.553 . . . . 74.540000000000006 111.228 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.9 p -130.84 121.1 24.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.951 -0.568 . . . . 73.239999999999995 110.224 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 17.0 p90 -129.5 129.35 44.44 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.366 0.603 . . . . 64.439999999999998 112.51 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.9 m -103.73 119.17 38.36 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.561 -0.745 . . . . 64.409999999999997 110.518 178.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.539 HG12 ' HG3' ' A' ' 3' ' ' MET . 24.2 mt -122.95 133.83 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 122.063 -0.398 . . . . 73.420000000000002 112.029 -175.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.4 HH21 ' CD ' ' A' ' 2' ' ' GLU . 35.0 ptt180 . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 121.122 0.487 . . . . 70.349999999999994 111.155 175.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.793 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 35.5 ttm . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.705 0.288 . . . . 75.420000000000002 111.022 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 77' ' ' ARG . 37.6 tt0 -127.2 132.63 50.42 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.683 0.278 . . . . 65.420000000000002 110.631 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.547 ' HG3' HG12 ' A' ' 76' ' ' ILE . 25.9 ttt -130.14 118.09 20.94 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 120.826 0.346 . . . . 73.219999999999999 111.576 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 13.4 t70 -97.49 114.66 26.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.832 0.453 . . . . 51.299999999999997 110.796 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 62.2 mt -121.84 113.54 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 122.372 0.269 . . . . 65.540000000000006 111.462 -177.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.543 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 6.0 ptm180 -106.93 138.06 43.82 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.136 0.493 . . . . 73.310000000000002 112.16 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.93 142.19 44.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.031 -0.531 . . . . 71.129999999999995 110.996 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.525 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 26.4 ttt85 -142.46 132.43 24.41 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.591 -0.277 . . . . 74.340000000000003 110.722 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.46 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -179.37 -165.48 33.61 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 120.441 -0.885 . . . . 75.310000000000002 113.949 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.23 -19.91 12.07 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 122.697 0.399 . . . . 74.120000000000005 111.885 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.3 118.2 8.31 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.18 0.514 . . . . 75.219999999999999 112.353 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.06 -61.01 2.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.978 -0.555 . . . . 55.149999999999999 112.352 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.573 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 43.5 tt0 -60.48 -26.64 66.96 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.057 0.391 . . . . 70.049999999999997 112.057 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.41 -28.79 31.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.676 0.274 . . . . 44.030000000000001 111.351 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.68 -60.36 3.67 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.336 -0.393 . . . . 65.049999999999997 111.337 174.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -71.01 -28.57 64.5 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.514 -0.312 . . . . 64.230000000000004 111.649 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HG2' ' HG2' ' A' ' 13' ' ' GLU . 31.8 mmmt -67.76 -54.91 15.46 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.863 0.363 . . . . 74.230000000000004 111.082 177.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -64.84 -51.59 61.24 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.261 -0.427 . . . . 73.150000000000006 111.437 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.97 -48.35 70.42 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.901 0.381 . . . . 74.510000000000005 111.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -60.85 -45.98 92.37 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.351 -0.386 . . . . 63.549999999999997 111.816 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 25' ' ' GLN . 17.3 mm-40 -64.15 -44.92 90.63 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.871 0.322 . . . . 72.340000000000003 111.871 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 96.6 mmm -56.56 -53.09 61.56 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.997 0.427 . . . . 63.350000000000001 111.335 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.558 ' HA ' HG21 ' A' ' 33' ' ' VAL . 60.9 mt -61.39 -41.07 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.243 0.544 . . . . 62.32 110.809 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.46 -36.6 64.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.594 -0.73 . . . . 64.329999999999998 111.995 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 21' ' ' GLU . 29.7 mm-40 -74.26 -54.18 8.24 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.997 0.427 . . . . 75.129999999999995 111.663 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.2 75.44 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.737 1.014 . . . . 73.140000000000001 113.737 -171.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -56.95 -27.81 61.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.232 0.827 . . . . 73.200000000000003 113.232 -174.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.06 -25.91 66.49 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.724 0.297 . . . . 52.329999999999998 111.688 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -107.88 -175.37 2.76 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.021 0.439 . . . . 70.219999999999999 111.802 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.38 33.5 0.35 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.005 0.431 . . . . 72.049999999999997 111.941 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.73 161.83 12.89 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.264 -0.493 . . . . 73.409999999999997 113.819 -175.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.7 m -132.22 135.96 46.67 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.463 0.305 . . . . 60.200000000000003 110.71 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 23' ' ' ILE . 95.0 t -98.25 113.86 34.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.044 0.45 . . . . 72.319999999999993 112.15 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 t -107.91 141.51 39.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.209 -0.45 . . . . 61.030000000000001 110.225 173.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 40.1 p90 -150.53 152.01 33.52 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.984 0.421 . . . . 74.230000000000004 112.094 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.3 t -132.36 138.58 47.79 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.078 -0.51 . . . . 75.540000000000006 111.5 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.18 140.35 37.47 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.918 0.389 . . . . 73.430000000000007 112.037 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.32 99.97 2.4 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 110.93 171.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.94 -95.13 0.06 OUTLIER Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.272 -0.49 . . . . 51.549999999999997 113.392 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.499 HD22 ' HG3' ' A' ' 8' ' ' ARG . 3.1 p-10 -111.31 4.65 19.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.062 0.393 . . . . 74.230000000000004 112.062 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -108.47 137.68 46.03 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.321 0.582 . . . . 54.149999999999999 112.477 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 tp -134.3 99.46 4.39 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.36 -0.836 . . . . 73.329999999999998 110.452 176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 31.7 mt-10 -93.0 115.97 28.62 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.162 -0.337 . . . . 71.109999999999999 111.217 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 74.1 mt -114.11 109.93 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 116.243 -0.435 . . . . 75.439999999999998 111.907 -176.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -106.53 132.13 52.89 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.002 -0.436 . . . . 73.239999999999995 111.354 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.535 HG12 HG22 ' A' ' 33' ' ' VAL . 45.8 mt -107.63 114.35 46.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.082 0.468 . . . . 74.140000000000001 110.805 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.7 m -101.61 122.35 43.7 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.272 -0.422 . . . . 74.219999999999999 111.846 -178.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.85 49.6 1.15 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.251 -0.5 . . . . 61.340000000000003 114.335 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.3 m -122.81 144.91 43.96 Favored Pre-proline 0 N--CA 1.472 0.65 0 O-C-N 122.233 -0.569 . . . . 71.519999999999996 112.269 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.39 160.06 39.28 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.03 2.487 . . . . 74.230000000000004 112.109 172.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -62.39 -36.94 83.89 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.994 -0.441 . . . . 72.409999999999997 111.955 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -61.11 -19.99 62.12 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.122 0.487 . . . . 75.310000000000002 111.183 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.75 -36.5 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 116.063 -0.517 . . . . 62.210000000000001 110.889 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.793 ' HD2' ' SD ' ' A' ' 1' ' ' MET . 31.4 ttt180 -45.55 -53.08 9.52 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.242 0.544 . . . . 71.430000000000007 111.528 173.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -58.77 -34.12 71.07 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.915 -0.584 . . . . 74.040000000000006 111.674 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -75.54 -35.26 60.72 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.285 -0.416 . . . . 71.230000000000004 111.428 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.84 -45.04 94.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.076 0.465 . . . . 74.510000000000005 110.849 176.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 62' ' ' GLU . . . -60.76 -50.42 73.55 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.149 -0.478 . . . . 71.040000000000006 111.159 175.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -55.17 -36.8 66.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.156 -0.475 . . . . 70.140000000000001 112.21 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -75.12 -43.89 50.2 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.975 0.417 . . . . 71.010000000000005 111.112 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.06 -38.05 78.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.755 0.312 . . . . 61.229999999999997 111.78 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 7.1 mm-40 -53.38 -46.34 69.61 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.971 0.415 . . . . 74.299999999999997 111.047 175.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ttm-85 -61.67 -50.93 70.52 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.965 0.412 . . . . 75.349999999999994 110.694 178.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.83 -43.88 66.32 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.908 -0.587 . . . . 73.219999999999999 111.778 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.468 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -66.18 -57.32 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.012 0.434 . . . . 52.340000000000003 111.981 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -62.67 -43.07 99.75 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.43 0.53 . . . . 75.209999999999994 112.43 -175.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.43 -36.86 83.71 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.804 -174.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.33 7.69 31.38 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.844 0.313 . . . . 65.129999999999995 111.844 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 58.38 27.69 15.74 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.028 0.442 . . . . 65.109999999999999 112.01 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 65' ' ' ALA . 24.5 pt -96.25 154.84 3.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 121.056 0.455 . . . . 72.230000000000004 111.062 178.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.525 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 45.8 p -88.31 143.14 27.2 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.959 0.409 . . . . 52.210000000000001 111.88 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 12.1 p -141.88 135.6 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.18 0.514 . . . . 75.25 112.172 -177.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.7 p -128.75 143.22 50.87 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.371 -0.377 . . . . 72.340000000000003 110.014 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 21.0 p90 -131.35 115.33 16.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.394 0.616 . . . . 73.239999999999995 112.279 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 96.6 m -104.19 124.93 50.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.729 -0.669 . . . . 74.219999999999999 110.418 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.547 HG12 ' HG3' ' A' ' 3' ' ' MET . 44.3 mt -118.64 139.81 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.131 0.491 . . . . 73.530000000000001 112.237 -174.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 2' ' ' GLU . 18.8 ptt180 . . . . . 0 CA--C 1.539 0.546 0 CA-C-N 116.117 -0.492 . . . . 62.420000000000002 110.636 174.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.7 ' SD ' ' HD3' ' A' ' 54' ' ' ARG . 47.5 ttp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.715 0.293 . . . . 75.540000000000006 111.144 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . 0.529 ' CD ' HH21 ' A' ' 45' ' ' ARG . 40.4 mt-10 -132.31 142.41 49.35 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.966 0.412 . . . . 75.519999999999996 111.36 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -133.06 118.63 18.99 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.289 0.566 . . . . 74.209999999999994 111.294 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -100.73 114.43 28.19 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.744 -0.662 . . . . 72.099999999999994 110.814 -178.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.1 mt -106.39 120.42 57.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.264 0.554 . . . . 74.409999999999997 111.365 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -103.7 105.32 15.51 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.067 -0.515 . . . . 72.140000000000001 111.747 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -93.56 146.98 23.4 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.156 0.503 . . . . 74.230000000000004 111.974 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -143.03 120.78 11.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.304 -0.407 . . . . 71.150000000000006 110.674 171.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.65 156.52 28.23 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.776 -0.726 . . . . 63.520000000000003 112.94 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -89.1 -30.15 18.86 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.807 0.336 . . . . 74.230000000000004 111.412 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.9 120.53 13.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.948 0.404 . . . . 62.439999999999998 111.793 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 48.1 tp -63.75 -41.27 98.04 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.993 0.425 . . . . 54.140000000000001 111.316 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.09 -36.8 71.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.088 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -40.56 83.53 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.332 -0.395 . . . . 75.409999999999997 111.423 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 12' ' ' LEU . 15.3 t80 -53.72 -58.68 6.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.193 -0.458 . . . . 72.340000000000003 111.74 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.69 -40.58 72.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.001 0.371 . . . . 72.219999999999999 112.001 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 67.9 mmtt -62.98 -46.7 86.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.393 0.516 . . . . 65.239999999999995 112.393 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.83 -49.05 79.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.902 0.382 . . . . 52.439999999999998 111.104 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -61.24 -41.02 96.17 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.128 0.489 . . . . 65.310000000000002 111.177 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -58.99 -54.86 42.42 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.768 -0.651 . . . . 74.329999999999998 111.802 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.99 -42.47 97.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.209 0.448 . . . . 72.010000000000005 112.209 -176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 85.3 mmm -57.66 -48.57 79.13 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.119 -0.363 . . . . 73.299999999999997 111.148 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 63.0 mt -66.47 -38.44 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.212 0.53 . . . . 74.510000000000005 110.863 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.633 -0.712 . . . . 63.439999999999998 111.624 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -73.89 -40.92 62.83 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.641 0.258 . . . . 73.439999999999998 111.58 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.13 -29.97 64.03 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.856 0.687 . . . . 74.420000000000002 112.856 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.5 mtp180 -56.77 -29.57 62.77 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.378 0.51 . . . . 74.239999999999995 112.378 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' NZ ' ' HB3' ' A' ' 28' ' ' LYS . 3.5 mmmp? -75.26 -13.27 60.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.038 0.447 . . . . 72.239999999999995 111.715 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -120.54 178.73 4.56 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.07 0.462 . . . . 73.239999999999995 111.281 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.99 38.0 0.33 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.193 0.52 . . . . 72.239999999999995 111.505 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.35 124.64 7.68 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 114.345 0.498 . . . . 71.409999999999997 114.345 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -101.38 117.76 35.6 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.691 0.396 . . . . 65.450000000000003 109.997 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.416 HG22 HG12 ' A' ' 46' ' ' ILE . 49.0 t -108.13 130.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 120.956 0.408 . . . . 63.43 112.047 -176.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -132.74 161.2 34.65 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.296 -0.411 . . . . 74.319999999999993 110.972 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 28.4 p90 -151.36 152.76 33.57 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.575 0.583 . . . . 72.109999999999999 112.575 -175.001 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 t -137.15 134.69 36.64 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.815 -0.63 . . . . 74.420000000000002 111.045 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.427 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.2 mm? -99.36 139.96 34.24 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.246 0.546 . . . . 73.400000000000006 112.3 -178.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -142.89 86.0 1.91 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.971 -0.558 . . . . 75.299999999999997 110.529 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.56 -89.76 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 121.367 -0.444 . . . . 70.129999999999995 113.481 -178.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -95.44 -25.76 16.12 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.691 0.397 . . . . 62.240000000000002 111.781 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -93.16 147.22 23.07 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.539 0.685 . . . . 75.219999999999999 112.659 -171.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.404 HD21 HD11 ' A' ' 44' ' ' ILE . 43.3 tp -134.95 104.33 5.93 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.158 -0.928 . . . . 71.140000000000001 110.192 178.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.46 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.3 tt0 -94.35 111.08 22.8 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.701 0.286 . . . . 73.420000000000002 111.107 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.404 HD11 HD21 ' A' ' 42' ' ' LEU . 65.8 mt -112.78 109.85 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-N 116.435 -0.348 . . . . 70.120000000000005 111.341 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.529 HH21 ' CD ' ' A' ' 2' ' ' GLU . 61.8 ttt180 -104.64 120.01 40.33 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.981 0.419 . . . . 74.540000000000006 111.145 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.416 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -106.95 125.89 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.936 0.398 . . . . 75.329999999999998 111.299 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -121.34 136.59 54.94 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.346 -0.388 . . . . 34.43 111.762 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.19 -13.94 40.24 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.755 -0.736 . . . . 71.239999999999995 114.193 174.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.35 138.1 95.72 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 117.268 0.534 . . . . 75.349999999999994 111.837 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.475 ' HG2' HG23 ' A' ' 53' ' ' VAL . 42.7 Cg_endo -68.8 152.6 73.91 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.382 2.055 . . . . 72.140000000000001 113.361 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -45.24 -43.11 10.12 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.836 1.05 . . . . 75.310000000000002 113.836 -176.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.21 -37.66 87.99 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.642 0.608 . . . . 70.400000000000006 112.642 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.532 HG12 ' HG ' ' A' ' 57' ' ' LEU . 57.6 t -73.89 -23.51 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.025 0.441 . . . . 74.200000000000003 111.708 -177.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 42.8 ttp180 -46.68 -50.52 17.71 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.334 0.588 . . . . 74.040000000000006 111.708 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -59.27 -44.77 92.42 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.244 -0.889 . . . . 70.219999999999999 112.029 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -68.95 -48.42 63.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.038 -0.528 . . . . 64.519999999999996 111.67 -175.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.532 ' HG ' HG12 ' A' ' 53' ' ' VAL . 87.1 mt -59.66 -33.85 72.08 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.555 0.217 . . . . 72.319999999999993 111.524 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.194 0.521 . . . . 61.310000000000002 110.594 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 ttpp -57.45 -45.46 84.73 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.752 -0.658 . . . . 72.400000000000006 111.226 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.98 95.67 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.49 -0.323 . . . . 74.340000000000003 111.79 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.37 -42.55 87.26 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.102 0.477 . . . . 45.329999999999998 111.291 177.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.29 -42.4 93.17 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.222 -0.444 . . . . 74.239999999999995 111.336 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -64.92 -37.96 89.37 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.734 0.302 . . . . 52.109999999999999 111.139 177.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.8 mt -57.38 -43.22 83.41 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.947 0.404 . . . . 65.349999999999994 110.65 172.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.98 -51.52 69.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.072 -0.513 . . . . 74.349999999999994 111.776 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -67.79 -26.24 65.99 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.222 0.453 . . . . 72.030000000000001 112.222 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.94 -50.56 72.97 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.949 0.404 . . . . 64.409999999999997 111.63 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -108.54 7.27 26.69 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.17 0.433 . . . . 74.200000000000003 112.17 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.8 t30 58.57 66.61 1.05 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.321 0.581 . . . . 74.430000000000007 111.356 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.8 pt -130.46 172.23 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 116.17 -0.468 . . . . 70.129999999999995 111.23 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.7 m -96.34 135.68 37.85 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.585 -0.279 . . . . 74.230000000000004 111.324 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.29 138.76 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.171 0.51 . . . . 60.219999999999999 112.118 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.6 p -127.43 172.87 10.28 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.999 -0.546 . . . . 63.240000000000002 109.742 172.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -145.92 115.77 7.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.364 0.602 . . . . 70.109999999999999 112.451 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 97.4 m -93.18 104.54 16.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.689 -0.687 . . . . 64.319999999999993 110.139 173.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.498 HG21 ' HD2' ' A' ' 54' ' ' ARG . 52.8 mt -111.93 129.42 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.947 0.403 . . . . 65.430000000000007 111.811 -175.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 . . . . . 0 CA--C 1.538 0.491 0 CA-C-O 121.177 0.513 . . . . 65.340000000000003 111.086 179.369 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.944 0.402 . . . . 73.530000000000001 111.358 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -115.11 148.02 39.49 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.244 -0.435 . . . . 70.530000000000001 110.949 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . 0.505 ' HG3' HG12 ' A' ' 76' ' ' ILE . 27.1 ttt -130.6 107.69 9.37 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.182 0.515 . . . . 71.140000000000001 111.663 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.511 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 2.9 m-20 -81.91 104.6 12.39 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.875 -0.602 . . . . 72.129999999999995 111.158 176.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.7 mt -107.74 109.41 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 120.99 0.424 . . . . 70.239999999999995 111.281 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.73 107.06 18.16 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.568 -0.287 . . . . 72.450000000000003 111.549 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.03 138.56 31.3 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.553 -0.294 . . . . 74.109999999999999 110.226 172.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -137.54 120.29 16.28 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.806 0.336 . . . . 64.319999999999993 110.615 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.4 149.53 16.08 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.053 -0.594 . . . . 55.340000000000003 112.938 -178.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.04 23.67 1.72 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 120.831 0.348 . . . . 63.310000000000002 111.648 -178.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -119.53 120.84 37.92 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 120.888 0.375 . . . . 72.420000000000002 111.393 -175.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 49.9 tp -72.23 -38.25 68.98 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.153 0.427 . . . . 64.319999999999993 112.153 -176.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.45 -40.4 93.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.88 0.372 . . . . 74.340000000000003 111.221 178.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.4 -43.32 83.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.164 -0.471 . . . . 72.230000000000004 111.156 175.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.553 ' HE1' HD13 ' A' ' 42' ' ' LEU . 56.6 t80 -50.03 -55.31 15.28 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.684 -0.689 . . . . 63.140000000000001 111.577 176.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.64 -56.28 19.22 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.975 0.361 . . . . 73.129999999999995 111.975 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -61.97 -49.29 76.7 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.674 0.62 . . . . 71.239999999999995 112.674 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.46 -48.38 82.03 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.974 0.416 . . . . 64.230000000000004 111.574 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.9 tp -62.76 -43.39 98.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.045 0.45 . . . . 74.25 111.473 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -57.95 -47.85 81.68 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.88 -0.6 . . . . 62.210000000000001 111.763 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -66.66 -33.15 75.01 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.372 0.508 . . . . 72.040000000000006 112.372 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.42 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.4 mmm -66.07 -47.61 73.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.976 0.417 . . . . 73.420000000000002 110.895 176.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.71 -39.55 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 116.282 -0.417 . . . . 72.239999999999995 111.033 177.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.0 ttm-85 -54.58 -45.45 73.56 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.138 0.494 . . . . 73.040000000000006 111.204 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -72.45 -45.92 57.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.235 -0.439 . . . . 53.439999999999998 111.548 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.82 -34.96 70.22 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.245 0.461 . . . . 71.409999999999997 112.245 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -58.44 -28.72 65.55 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.043 0.386 . . . . 75.409999999999997 112.043 177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -66.21 -33.66 76.26 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.13 0.491 . . . . 74.120000000000005 111.228 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -96.54 -178.03 4.13 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 111.425 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.18 4.12 43.71 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.21 0.448 . . . . 72.129999999999995 112.21 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.91 159.62 42.02 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.186 -0.53 . . . . 50.32 113.812 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.7 m -119.1 144.49 46.58 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 122.609 -0.348 . . . . 52.009999999999998 110.767 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.401 HG22 HG12 ' A' ' 46' ' ' ILE . 64.5 t -117.7 124.43 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 112.036 0.384 . . . . 71.420000000000002 112.036 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -118.31 148.69 42.22 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.441 -0.345 . . . . 63.43 110.483 172.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' LEU . 52.7 p90 -150.71 138.25 19.66 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.483 . . . . 73.430000000000007 112.138 -177.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.2 p -123.88 119.78 30.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.09 -0.504 . . . . 54.219999999999999 110.808 176.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.4 tp -93.73 101.47 13.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.119 0.485 . . . . 74.140000000000001 111.629 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -99.04 96.88 8.1 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.122 -0.49 . . . . 74.219999999999999 110.773 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.64 -90.33 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.3 -0.476 . . . . 64.140000000000001 113.154 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -119.6 -1.04 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.855 0.36 . . . . 73.5 111.11 179.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.15 121.81 44.59 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.273 -0.421 . . . . 75.400000000000006 111.396 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.553 HD13 ' HE1' ' A' ' 15' ' ' PHE . 64.6 tp -104.02 99.67 9.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.177 0.513 . . . . 73.420000000000002 110.659 176.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -85.28 104.52 15.2 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.215 -0.448 . . . . 72.340000000000003 111.197 179.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.5 mt -103.48 136.41 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.346 -0.388 . . . . 73.540000000000006 111.395 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -125.39 115.6 20.55 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.943 0.401 . . . . 71.049999999999997 110.771 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.401 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -101.64 115.3 43.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.036 0.446 . . . . 73.430000000000007 110.689 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.9 m -101.43 123.68 45.88 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.284 -0.416 . . . . 74.129999999999995 111.6 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.22 65.01 1.22 Allowed Glycine 0 CA--C 1.527 0.798 0 C-N-CA 121.091 -0.576 . . . . 73.109999999999999 113.46 176.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.6 m -113.85 133.87 22.2 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 122.551 -0.382 . . . . 71.109999999999999 111.923 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.453 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 37.5 Cg_endo -65.57 125.78 14.98 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.578 2.186 . . . . 73.319999999999993 112.837 178.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -54.7 -34.44 62.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.483 0.549 . . . . 75.430000000000007 112.483 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.528 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.7 pt20 -63.92 -40.02 95.5 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.737 0.303 . . . . 65.310000000000002 111.763 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.528 HG23 ' HG3' ' A' ' 52' ' ' GLN . 58.4 t -86.75 -19.07 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.816 0.341 . . . . 73.120000000000005 111.498 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HD2' HD13 ' A' ' 76' ' ' ILE . 16.4 ttp180 -48.81 -36.35 16.55 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.287 0.477 . . . . 63.140000000000001 112.287 -178.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -61.42 -40.97 96.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.879 0.371 . . . . 65.230000000000004 111.481 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -69.84 -35.94 75.15 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.798 0.333 . . . . 70.450000000000003 111.042 177.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.44 -43.2 91.15 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.057 0.456 . . . . 53.240000000000002 110.853 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.53 94.43 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.243 0.544 . . . . 75.329999999999998 110.865 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 27.9 ttpt -59.64 -50.74 72.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.025 -0.534 . . . . 63.030000000000001 111.189 174.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -69.64 -37.8 76.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.94 -0.573 . . . . 63.43 111.713 -174.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.17 -51.82 55.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.042 0.449 . . . . 60.32 111.493 178.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 42.2 mt-10 -72.92 -31.49 64.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.484 -0.326 . . . . 63.240000000000002 111.357 176.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -57.3 -48.67 78.33 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.882 0.372 . . . . 72.310000000000002 110.306 178.419 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.9 mt -52.79 -47.3 67.68 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.991 -0.549 . . . . 63.329999999999998 111.188 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.81 -42.06 83.46 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.051 -0.522 . . . . 75.540000000000006 111.874 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 62.1 mttm -68.64 -26.61 65.42 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.404 -0.362 . . . . 73.140000000000001 111.664 -178.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -68.55 -48.99 62.84 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.198 0.523 . . . . 72.329999999999998 111.198 174.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -96.14 1.33 52.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.487 0.551 . . . . 62.420000000000002 112.487 -175.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 61.72 26.17 15.88 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.084 0.401 . . . . 71.329999999999998 112.084 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -103.65 175.58 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 121.215 0.531 . . . . 63.32 112.425 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.8 m -97.3 139.73 32.83 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 112.042 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -146.37 137.28 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.978 0.418 . . . . 73.109999999999999 111.663 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.4 p -128.66 139.11 52.41 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 116.664 -0.244 . . . . 53.450000000000003 110.594 175.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 43.5 p90 -127.27 119.38 26.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.363 0.601 . . . . 74.439999999999998 112.476 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . 0.443 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 71.7 m -103.55 139.81 38.37 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.733 -0.667 . . . . 74.329999999999998 109.714 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.505 HG12 ' HG3' ' A' ' 3' ' ' MET . 56.3 mt -131.15 128.49 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 121.864 -0.522 . . . . 75.140000000000001 112.408 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 . . . . . 0 CA--C 1.538 0.511 0 N-CA-C 109.884 -0.413 . . . . 75.439999999999998 109.884 173.945 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.516 ' HE1' ' HA ' ' A' ' 51' ' ' GLU . 55.4 ttp . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 120.994 0.426 . . . . 72.150000000000006 111.532 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.07 146.3 51.06 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.573 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.0 ptm -131.65 121.95 25.15 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.9 0.704 . . . . 61.350000000000001 112.9 -175.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.55 ' HB3' ' NH1' ' A' ' 6' ' ' ARG . 3.8 m-20 -86.01 134.9 33.83 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.868 -0.605 . . . . 74.209999999999994 111.545 173.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.3 mt -139.24 133.24 39.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.101 0.56 . . . . 73.329999999999998 110.055 173.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.55 ' NH1' ' HB3' ' A' ' 4' ' ' ASP . 49.9 mtt85 -132.84 113.23 12.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.974 0.416 . . . . 72.319999999999993 112.02 -175.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.516 ' HE1' ' SD ' ' A' ' 22' ' ' MET . 97.0 m-85 -93.25 142.55 27.19 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.305 -0.407 . . . . 61.439999999999998 110.9 177.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.1 ttt180 -142.37 127.13 18.12 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.536 0.208 . . . . 70.239999999999995 111.514 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.558 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -170.27 -175.37 39.07 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 120.842 -0.694 . . . . 61.329999999999998 113.948 -178.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -95.2 -50.88 4.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.986 0.365 . . . . 74.109999999999999 111.986 -176.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -61.36 114.48 3.22 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.9 0.381 . . . . 73.109999999999999 111.049 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.55 -50.42 73.86 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.645 0.609 . . . . 64.209999999999994 112.645 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 22.0 mt-10 -56.23 -25.42 47.43 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.855 0.687 . . . . 72.540000000000006 112.855 -178.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.08 -34.02 59.08 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.754 0.311 . . . . 74.319999999999993 111.608 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.498 ' HB3' HD22 ' A' ' 42' ' ' LEU . 78.6 m-85 -72.05 -60.2 2.35 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.505 -0.316 . . . . 65.230000000000004 111.476 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 10.9 pt-20 -57.67 -40.67 79.9 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.122 0.416 . . . . 73.340000000000003 112.122 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -70.21 -42.45 72.32 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.1 0.407 . . . . 73.549999999999997 112.1 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -46.72 82.48 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.211 0.529 . . . . 64.430000000000007 110.415 174.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.427 ' HB2' HD21 ' A' ' 42' ' ' LEU . 64.3 tp -56.05 -43.57 78.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.69 -0.686 . . . . 72.099999999999994 111.247 175.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -56.14 -46.11 79.36 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.062 -0.517 . . . . 74.409999999999997 111.498 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -65.99 -40.26 91.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.714 0.292 . . . . 65.340000000000003 111.677 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' MET . . . . . 0.516 ' SD ' ' HE1' ' A' ' 7' ' ' PHE . 80.8 mtp -61.37 -53.29 58.52 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.72 0.295 . . . . 74.019999999999996 111.202 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.613 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 69.1 mt -59.49 -42.31 87.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-O 120.931 0.396 . . . . 74.010000000000005 110.506 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -48.41 -50.34 31.4 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.948 -0.569 . . . . 65.310000000000002 111.562 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -75.14 -33.02 61.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.913 0.387 . . . . 62.030000000000001 111.663 178.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -31.9 73.27 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.384 0.512 . . . . 61.350000000000001 112.384 -178.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 43.3 mtp180 -63.91 -27.84 69.42 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.93 0.395 . . . . 73.519999999999996 111.333 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -57.13 -25.03 58.17 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.136 -0.484 . . . . 74.120000000000005 111.486 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -120.16 167.74 11.92 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.988 0.423 . . . . 75.340000000000003 110.999 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.13 87.27 7.15 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.469 . . . . 54.109999999999999 110.748 176.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -146.42 157.68 27.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.836 -0.697 . . . . 72.030000000000001 113.474 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.9 m -106.98 128.81 54.68 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 122.793 -0.24 . . . . 72.519999999999996 111.276 -179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -110.6 109.38 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 120.77 0.319 . . . . 73.230000000000004 111.33 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.6 p -101.06 130.46 47.09 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.392 0.277 . . . . 61.340000000000003 110.286 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 47.5 p90 -144.01 150.2 37.88 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.66 0.615 . . . . 71.549999999999997 112.66 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -139.28 133.59 31.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.993 -0.548 . . . . 71.349999999999994 111.398 171.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.8 tp -95.28 106.33 18.35 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.018 0.437 . . . . 71.010000000000005 110.483 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -126.82 118.23 24.22 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.023 0.44 . . . . 52.43 111.411 -172.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.04 -101.4 0.6 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.338 -0.458 . . . . 74.400000000000006 113.049 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -122.1 6.1 9.77 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 71.430000000000007 111.089 176.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.82 139.51 49.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.357 0.598 . . . . 71.329999999999998 112.067 -176.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.498 HD22 ' HB3' ' A' ' 15' ' ' PHE . 64.7 tp -108.02 101.72 10.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.102 -0.499 . . . . 72.010000000000005 109.84 172.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.519 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 7.9 tm-20 -81.52 115.04 20.64 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.925 -0.58 . . . . 74.510000000000005 110.556 -177.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -123.86 129.44 74.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 120.788 0.327 . . . . 74.209999999999994 111.616 -177.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -126.43 127.5 45.52 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 122.129 -0.357 . . . . 74.340000000000003 111.024 174.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.3 mt -111.89 124.22 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-O 120.976 0.417 . . . . 42.229999999999997 111.122 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -105.63 130.72 53.6 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.178 -0.465 . . . . 65.450000000000003 111.953 -177.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.67 28.47 8.89 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.197 -0.525 . . . . 61.549999999999997 113.832 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.484 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 13.7 m -89.63 134.72 31.81 Favored Pre-proline 0 CA--C 1.543 0.703 0 O-C-N 122.41 -0.465 . . . . 71.319999999999993 111.974 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 8.1 Cg_exo -74.9 144.77 31.04 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.862 2.375 . . . . 60.130000000000003 113.023 177.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 3.1 tm-20 -53.2 -48.43 68.11 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 120.98 0.419 . . . . 72.340000000000003 111.28 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.427 ' HG3' HG23 ' A' ' 53' ' ' VAL . 20.6 pt20 -56.13 -28.63 58.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.367 0.506 . . . . 74.120000000000005 112.367 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.427 HG23 ' HG3' ' A' ' 52' ' ' GLN . 46.4 t -94.92 -22.87 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.965 0.412 . . . . 74.329999999999998 111.262 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.435 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 23.2 ttp180 -50.84 -49.4 58.94 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.142 0.496 . . . . 73.140000000000001 111.598 179.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -54.77 -40.84 69.79 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.573 -0.74 . . . . 63.310000000000002 111.968 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.5 -44.87 66.75 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.437 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.409 ' HG ' HG12 ' A' ' 53' ' ' VAL . 94.4 mt -63.98 -42.96 97.06 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.773 0.32 . . . . 64.519999999999996 111.77 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.95 -50.04 72.36 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.894 0.378 . . . . 51.109999999999999 111.136 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 2.7 tmmm? -56.72 -47.55 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.135 -0.484 . . . . 74.510000000000005 110.531 175.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.49 -40.63 87.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.155 -0.475 . . . . 72.129999999999995 110.96 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.41 -46.26 86.79 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.929 0.395 . . . . 71.329999999999998 111.488 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.67 -41.61 95.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.069 0.461 . . . . 62.439999999999998 111.049 176.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.66 -42.03 98.14 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.356 -0.384 . . . . 70.239999999999995 111.289 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.25 -48.31 79.19 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.997 0.427 . . . . 63.119999999999997 111.179 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.413 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -53.53 -55.63 23.89 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.011 -0.54 . . . . 71.340000000000003 111.321 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -60.25 -35.47 75.55 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.228 -0.442 . . . . 72.099999999999994 111.975 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.96 -46.53 88.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.138 0.494 . . . . 74.129999999999995 111.397 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.18 7.58 43.68 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.488 -0.324 . . . . 65.510000000000005 111.783 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t30 58.82 32.93 22.71 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.583 0.706 . . . . 62.32 111.058 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.558 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.3 pt -111.78 164.09 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 116.178 -0.464 . . . . 42.200000000000003 111.512 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 53.9 m -94.98 134.67 37.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.382 -0.372 . . . . 64.239999999999995 111.039 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 12.7 p -122.96 135.8 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 121.27 0.557 . . . . 74.319999999999993 112.202 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.6 p -128.84 141.34 51.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.053 -0.521 . . . . 73.439999999999998 110.008 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -139.72 160.87 38.9 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.608 0.596 . . . . 62.420000000000002 112.608 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.1 m -149.93 109.67 4.06 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.785 -0.643 . . . . 75.349999999999994 110.154 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -106.09 127.95 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 112.148 0.425 . . . . 74.150000000000006 112.148 -174.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 1' ' ' MET . 45.9 mtt180 . . . . . 0 N--CA 1.47 0.545 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 111.125 -179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.4 ' HE3' HG23 ' A' ' 49' ' ' VAL . 59.0 ttp . . . . . 0 N--CA 1.49 1.537 0 CA-C-O 120.809 0.338 . . . . 75.25 110.761 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.428 ' HG3' ' HA ' ' A' ' 47' ' ' THR . 4.5 mp0 -104.75 165.9 10.75 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.349 -0.387 . . . . 72.25 110.721 179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.401 ' HG3' HD13 ' A' ' 76' ' ' ILE . 27.4 ttt -143.83 117.34 9.14 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 122.108 -0.37 . . . . 70.219999999999999 111.804 -179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 20.9 m-20 -94.62 103.85 15.79 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 120.812 0.339 . . . . 71.439999999999998 111.188 176.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 47.5 mt -99.43 108.89 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 CA-C-O 120.893 0.377 . . . . 71.230000000000004 110.563 176.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 58.0 mtp180 -99.94 107.21 19.12 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.604 -0.271 . . . . 64.519999999999996 111.497 -176.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -90.35 126.58 35.92 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.796 0.331 . . . . 65.349999999999994 111.161 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.561 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 73.8 ttt-85 -127.06 120.12 28.22 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 110.067 -0.346 . . . . 74.549999999999997 110.067 178.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -142.57 -170.73 12.89 Favored Glycine 0 N--CA 1.466 0.644 0 C-N-CA 120.653 -0.784 . . . . 74.420000000000002 113.853 -172.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -103.9 -47.06 4.31 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.561 0.578 . . . . 72.409999999999997 112.561 -178.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -100.83 152.79 20.1 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.961 -0.462 . . . . 73.430000000000007 111.688 176.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 59.0 tp -64.97 -36.66 85.11 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.175 0.435 . . . . 72.439999999999998 112.175 -177.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.5 mp0 -58.53 -32.82 69.21 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 116.384 -0.371 . . . . 74.120000000000005 111.248 -177.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -56.37 -45.48 80.5 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.063 0.459 . . . . 75.120000000000005 111.143 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -67.5 -47.05 71.12 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.142 0.496 . . . . 75.129999999999995 110.792 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.2 tp10 -54.41 -57.94 9.37 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.723 -0.671 . . . . 71.420000000000002 112.14 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -65.33 -47.82 75.18 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.272 -0.422 . . . . 75.310000000000002 111.6 -176.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -57.7 -51.2 70.5 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.945 0.403 . . . . 73.140000000000001 111.582 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.23 -45.06 88.39 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.139 0.495 . . . . 72.120000000000005 111.447 177.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 50.1 tttt -67.31 -31.73 72.22 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-N 116.141 -0.481 . . . . 63.32 111.752 -175.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 27.0 mm-40 -70.18 -39.16 75.42 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 120.762 0.315 . . . . 73.310000000000002 111.444 174.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 90.5 mmm -59.93 -52.45 65.38 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 116.543 -0.299 . . . . 75.540000000000006 110.532 174.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.481 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 72.5 mt -58.02 -40.45 76.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.637 0 CA-C-O 121.139 0.495 . . . . 70.140000000000001 111.209 176.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.413 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 68.9 ttt180 -48.52 -58.73 4.24 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.689 -0.687 . . . . 73.540000000000006 111.824 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -75.73 -39.22 57.63 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 112.41 0.522 . . . . 73.540000000000006 112.41 178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.2 -30.03 59.11 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.563 0.579 . . . . 74.409999999999997 112.563 -175.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 74.9 mtp180 -59.87 -28.99 68.01 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 112.081 0.4 . . . . 71.129999999999995 112.081 177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.416 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 12.7 mptt -74.16 -14.9 61.02 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.678 0.275 . . . . 71.099999999999994 111.56 178.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.6 m-85 -110.79 149.47 30.5 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 120.84 0.352 . . . . 72.120000000000005 111.016 -179.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.08 58.17 1.94 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 121.281 0.562 . . . . 61.299999999999997 111.559 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -131.0 133.15 7.13 Favored Glycine 0 CA--C 1.525 0.699 0 CA-C-N 116.107 -0.497 . . . . 75.549999999999997 112.276 -179.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.4 m -85.97 117.83 25.06 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.857 0.361 . . . . 63.509999999999998 111.627 -176.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.7 t -92.31 109.59 21.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.229 0.538 . . . . 64.450000000000003 111.927 -176.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 31.4 p -113.41 153.58 28.37 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.208 -0.451 . . . . 73.129999999999995 110.153 175.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -156.43 149.05 23.69 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.667 0.617 . . . . 73.400000000000006 112.667 178.734 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 66.1 p -130.29 126.57 37.57 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.637 -0.71 . . . . 70.209999999999994 110.811 176.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 52.1 tp -97.87 99.42 10.74 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.048 0.452 . . . . 72.310000000000002 110.926 179.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -106.18 106.66 17.28 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.967 0.413 . . . . 72.040000000000006 110.838 -177.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 60.7 -112.92 5.03 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.12 -0.562 . . . . 63.329999999999998 112.335 -175.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 8' ' ' ARG . 47.3 t-20 -115.67 72.3 0.8 Allowed 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.03 0.443 . . . . 72.219999999999999 110.175 173.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -175.99 122.28 0.18 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.576 -0.738 . . . . 63.450000000000003 109.785 176.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.2 tp -104.74 101.14 10.77 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.206 -0.452 . . . . 72.010000000000005 111.047 -178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -85.09 104.45 15.01 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 116.472 -0.331 . . . . 75.200000000000003 111.095 -179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 47.9 mt -99.6 109.07 23.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 111.773 0.286 . . . . 74.409999999999997 111.773 -178.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 30.8 ttm180 -98.87 106.23 18.47 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 121.185 0.517 . . . . 62.020000000000003 111.578 177.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.9 mt -91.8 112.01 24.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.522 0 CA-C-N 116.184 -0.462 . . . . 73.340000000000003 110.298 174.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.428 ' HA ' ' HG3' ' A' ' 2' ' ' GLU . 91.7 m -93.04 120.44 33.34 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.218 -0.446 . . . . 44.009999999999998 112.0 -176.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.87 65.13 1.09 Allowed Glycine 0 CA--C 1.527 0.8 0 C-N-CA 121.434 -0.412 . . . . 72.409999999999997 113.922 176.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.4 HG23 ' HE3' ' A' ' 1' ' ' MET . 16.4 m -122.06 136.56 26.4 Favored Pre-proline 0 CA--C 1.54 0.573 0 O-C-N 122.405 -0.468 . . . . 74.540000000000006 111.914 177.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -78.65 150.8 24.72 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 122.598 2.199 . . . . 73.140000000000001 112.461 175.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -60.06 -30.63 69.34 Favored 'General case' 0 N--CA 1.472 0.661 0 N-CA-C 112.852 0.686 . . . . 64.230000000000004 112.852 -174.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG3' HG23 ' A' ' 53' ' ' VAL . 28.9 pt20 -63.58 -45.62 89.59 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.948 0.404 . . . . 74.420000000000002 111.308 177.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.462 HG23 ' HG3' ' A' ' 52' ' ' GLN . 61.3 t -77.08 -27.72 16.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.869 0.366 . . . . 63.539999999999999 111.109 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 52.2 ttp180 -48.94 -40.98 32.38 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.161 0.505 . . . . 71.430000000000007 111.193 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.1 mttm -60.91 -51.84 67.58 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 115.822 -0.626 . . . . 71.420000000000002 111.311 177.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -62.09 -44.65 96.19 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 115.828 -0.624 . . . . 75.329999999999998 112.097 -176.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.9 mt -67.31 -45.68 75.79 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 120.771 0.319 . . . . 71.409999999999997 111.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.39 -39.91 94.79 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.059 0.457 . . . . 73.439999999999998 111.508 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -72.27 -34.89 68.54 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.156 -0.475 . . . . 65.230000000000004 112.064 -178.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -71.39 -31.99 67.93 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.262 -0.575 . . . . 65.209999999999994 110.566 175.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -56.09 -44.09 78.67 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.951 0.405 . . . . 72.299999999999997 110.498 171.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -58.1 -50.0 74.99 Favored 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 121.335 0.588 . . . . 52.350000000000001 110.43 172.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.411 HH11 ' HD2' ' A' ' 63' ' ' ARG . 13.5 tpt180 -53.41 -48.77 68.4 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 115.347 -0.842 . . . . 72.329999999999998 111.475 179.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 83.5 mt -57.73 -50.69 72.39 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.182 0.515 . . . . 44.039999999999999 111.046 176.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.78 -26.39 65.69 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.09 -0.504 . . . . 44.439999999999998 111.868 178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -74.38 -59.8 2.56 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 122.372 -0.205 . . . . 74.040000000000006 111.463 177.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -57.85 -35.45 70.95 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.304 0.483 . . . . 72.310000000000002 112.304 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -92.79 -6.87 48.0 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 122.185 -0.322 . . . . 74.25 111.8 178.079 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.1 t30 57.93 15.83 3.34 Favored 'General case' 0 N--CA 1.477 0.877 0 CA-C-O 121.395 0.617 . . . . 71.549999999999997 111.828 179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.1 pt -87.1 174.88 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.486 0 CA-C-O 121.051 0.453 . . . . 65.150000000000006 111.84 -178.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.561 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.1 m -90.01 139.06 30.98 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.196 -0.456 . . . . 75.409999999999997 111.317 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.2 p -135.67 126.6 43.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 CA-C-O 121.183 0.516 . . . . 73.25 111.472 176.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 71.8 p -129.64 120.53 25.38 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.419 -0.355 . . . . 44.119999999999997 110.333 175.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -121.22 117.79 27.97 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.063 0.459 . . . . 75.439999999999998 112.019 -174.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.8 m -98.82 116.86 31.99 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 120.902 0.382 . . . . 74.530000000000001 111.037 179.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.401 HD13 ' HG3' ' A' ' 3' ' ' MET . 42.6 mm -82.0 112.37 19.76 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-N 116.446 -0.343 . . . . 44.140000000000001 111.041 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 77' ' ' ARG . 19.3 mmm180 -78.86 101.6 7.76 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 120.936 0.398 . . . . 72.519999999999996 110.552 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 96.1 mt -80.0 131.94 35.91 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.459 0.54 . . . . 72.219999999999999 112.459 -174.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -65.04 116.39 6.4 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.84 -0.618 . . . . 75.540000000000006 109.8 173.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -121.31 168.37 11.71 Favored 'General case' 0 N--CA 1.47 0.54 0 N-CA-C 112.707 0.632 . . . . 72.129999999999995 112.707 -171.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -168.67 117.4 0.7 Allowed 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.593 -0.73 . . . . 71.140000000000001 110.728 -177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 55.5 t-80 -62.04 93.92 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.92 0.39 . . . . 73.450000000000003 110.731 178.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -63.13 163.82 9.51 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 113.008 0.744 . . . . 73.219999999999999 113.008 -176.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -98.41 -39.92 8.54 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.973 -0.558 . . . . 73.349999999999994 111.215 176.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 35.8 p80 . . . . . 0 C--O 1.251 1.146 0 CA-C-O 119.268 -0.396 . . . . 73.120000000000005 111.674 179.845 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.542 ' HG2' HD13 ' A' ' 78' ' ' LEU . 75.3 mtm . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 120.779 0.323 . . . . 74.030000000000001 111.468 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.585 ' HB2' ' HG3' ' A' ' 77' ' ' ARG . 39.8 mt-10 -124.32 163.09 22.42 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 121.281 0.563 . . . . 72.510000000000005 111.862 -178.017 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.67 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 25.7 ttt -143.59 111.95 6.34 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.061 -0.518 . . . . 74.140000000000001 111.613 -177.217 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.43 120.78 28.13 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.661 0.267 . . . . 71.319999999999993 111.043 175.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 44' ' ' ILE . 22.5 mt -124.64 147.64 29.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.876 0.37 . . . . 73.129999999999995 111.814 -174.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.1 mtt-85 -136.05 110.37 8.44 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.429 -0.35 . . . . 74.510000000000005 110.987 170.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 75.2 m-85 -89.28 124.18 34.17 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.825 -0.435 . . . . 71.239999999999995 109.825 172.057 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.45 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 58.2 ttt180 -124.24 125.44 44.4 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.024 0.44 . . . . 71.140000000000001 111.852 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 170.76 -168.12 41.24 Favored Glycine 0 CA--C 1.527 0.83 0 C-N-CA 120.846 -0.692 . . . . 43.310000000000002 113.608 179.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -123.07 90.17 3.24 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 122.666 0.386 . . . . 74.430000000000007 110.852 -179.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -175.95 142.26 0.51 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 116.149 -0.478 . . . . 62.299999999999997 110.372 178.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.412 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 35.0 tp -89.28 -39.63 13.35 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 111.853 0.316 . . . . 73.420000000000002 111.853 -176.506 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -66.66 -32.26 73.46 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 122.17 -0.331 . . . . 73.319999999999993 111.251 179.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.69 -41.91 70.81 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-O 121.057 0.456 . . . . 74.129999999999995 110.909 173.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.467 ' CD1' HD22 ' A' ' 42' ' ' LEU . 62.4 t80 -58.83 -56.74 18.27 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.797 -0.638 . . . . 63.539999999999999 111.502 176.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -63.08 -52.33 63.11 Favored 'General case' 0 CA--C 1.538 0.504 0 N-CA-C 112.144 0.424 . . . . 71.409999999999997 112.144 -176.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -62.43 -54.59 38.02 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.763 0.653 . . . . 74.530000000000001 112.763 -176.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.46 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.15 -43.86 87.59 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-O 120.92 0.391 . . . . 75.230000000000004 111.558 -178.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 56.2 tp -66.81 -42.54 85.75 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-O 120.975 0.417 . . . . 72.530000000000001 111.327 177.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -59.33 -52.77 64.23 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.155 -0.475 . . . . 53.329999999999998 111.985 -177.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -60.93 -49.59 76.85 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 112.203 0.445 . . . . 74.209999999999994 112.203 -176.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 51.4 mtp -62.94 -40.81 98.78 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.739 0.274 . . . . 44.020000000000003 111.739 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 51.3 mt -64.16 -41.92 93.93 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 120.974 0.416 . . . . 62.420000000000002 110.624 174.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.3 -46.53 79.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 116.061 -0.518 . . . . 72.340000000000003 111.136 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' A' ' 28' ' ' LYS . 29.7 mt-30 -74.3 -36.11 63.72 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 112.308 0.484 . . . . 71.400000000000006 112.308 177.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.86 -47.1 87.91 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.934 -0.479 . . . . 73.310000000000002 111.618 178.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 31.0 mtp180 -59.63 -39.49 84.49 Favored 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 112.744 0.646 . . . . 72.450000000000003 112.744 -177.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' A' ' 25' ' ' GLN . 20.8 ptmt -69.37 -14.33 62.85 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.987 0.422 . . . . 75.129999999999995 111.372 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -108.43 15.18 24.15 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.445 -0.343 . . . . 73.0 111.119 173.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 65.88 16.81 10.63 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.532 0.567 . . . . 74.540000000000006 112.532 178.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -78.43 133.31 12.61 Favored Glycine 0 CA--C 1.529 0.934 0 C-N-CA 121.442 -0.409 . . . . 52.130000000000003 113.587 -179.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 98.7 m -90.85 122.5 33.61 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.542 -0.387 . . . . 75.540000000000006 111.117 178.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.443 HG22 HG12 ' A' ' 46' ' ' ILE . 49.9 t -109.03 130.17 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-O 120.96 0.41 . . . . 70.219999999999999 111.871 -179.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 6.9 t -124.64 132.79 53.4 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 116.519 -0.309 . . . . 74.420000000000002 110.794 174.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.524 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.7 p90 -128.34 144.92 51.19 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 112.369 0.507 . . . . 73.209999999999994 112.369 -177.067 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 37.8 p -137.84 133.24 33.7 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.96 -0.564 . . . . 72.239999999999995 111.13 178.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.55 115.44 21.53 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 120.747 0.308 . . . . 72.200000000000003 111.31 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -114.21 81.39 1.53 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.383 0.611 . . . . 65.230000000000004 111.496 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.72 -85.09 0.03 OUTLIER Glycine 0 CA--C 1.529 0.91 0 N-CA-C 114.814 0.685 . . . . 55.310000000000002 114.814 174.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -100.06 -10.74 21.21 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 112.473 0.546 . . . . 51.310000000000002 112.473 -171.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -146.51 160.87 41.57 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 113.065 0.765 . . . . 71.420000000000002 113.065 -175.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.524 HD11 ' HB2' ' A' ' 35' ' ' TYR . 50.6 tp -101.49 116.31 32.48 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.501 -0.772 . . . . 72.329999999999998 111.883 178.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HB2' ' OG1' ' A' ' 36' ' ' THR . 38.0 mt-10 -79.83 129.96 34.92 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.536 -0.302 . . . . 70.200000000000003 110.725 175.011 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.469 ' HB ' ' HB ' ' A' ' 5' ' ' ILE . 66.5 mt -134.58 121.86 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 122.407 0.283 . . . . 73.040000000000006 111.069 179.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.489 ' HA ' ' O ' ' A' ' 3' ' ' MET . 42.5 ttm180 -118.66 120.84 38.63 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.073 0.463 . . . . 61.200000000000003 111.032 174.559 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.49 ' O ' ' HA ' ' A' ' 2' ' ' GLU . 49.7 mt -101.49 129.08 53.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.49 0 CA-C-N 116.121 -0.49 . . . . 74.510000000000005 110.777 176.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.424 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 57.5 m -120.89 143.39 48.95 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 122.313 0.245 . . . . 71.409999999999997 111.6 -176.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.44 10.91 60.14 Favored Glycine 0 CA--C 1.529 0.95 0 C-N-CA 121.119 -0.562 . . . . 72.25 114.396 174.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.465 HG21 ' HE ' ' A' ' 54' ' ' ARG . 19.2 m -89.39 136.4 29.98 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 117.32 0.56 . . . . 74.430000000000007 112.077 179.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.8 Cg_endo -73.09 174.32 12.21 Favored 'Trans proline' 0 CA--C 1.547 1.141 0 C-N-CA 122.976 2.451 . . . . 71.219999999999999 113.316 -179.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.411 ' HA ' ' HE2' ' A' ' 1' ' ' MET . 13.7 pt-20 -66.42 -49.38 66.96 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 113.624 0.972 . . . . 73.230000000000004 113.624 -171.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -67.21 -41.48 85.7 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 121.883 -0.51 . . . . 75.209999999999994 111.262 -176.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.59 -31.45 48.94 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.182 0.515 . . . . 70.310000000000002 110.992 178.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.67 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 3.8 tpm_? -52.51 -43.26 64.97 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.008 -0.542 . . . . 72.430000000000007 111.321 176.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 89.9 mttt -61.85 -52.85 62.44 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 115.811 -0.631 . . . . 62.43 111.68 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -61.74 -43.06 99.58 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 116.254 -0.43 . . . . 65.349999999999994 111.86 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -62.81 -36.77 84.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 120.961 0.41 . . . . 73.400000000000006 111.491 176.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.26 70.82 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 120.993 0.425 . . . . 65.349999999999994 111.328 176.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -78.3 -34.59 48.7 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 116.284 -0.416 . . . . 61.149999999999999 111.452 178.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -61.73 -41.49 97.71 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 111.776 0.287 . . . . 65.25 111.776 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -51.06 -43.59 60.99 Favored 'General case' 0 N--CA 1.472 0.625 0 CA-C-O 121.103 0.478 . . . . 72.409999999999997 111.716 177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -60.65 -41.68 95.48 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.117 -0.492 . . . . 73.329999999999998 111.416 176.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 13.1 tpt180 -62.71 -52.95 61.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.044 -0.526 . . . . 75.049999999999997 110.937 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.46 HD22 ' HA ' ' A' ' 18' ' ' ALA . 86.4 mt -50.14 -48.54 53.68 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 115.89 -0.595 . . . . 71.099999999999994 111.998 179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.46 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -58.78 -52.65 64.83 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 116.025 -0.534 . . . . 44.109999999999999 111.873 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.4 mtpp -62.64 -35.05 78.36 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.601 0.593 . . . . 73.150000000000006 112.601 -176.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.6 mm-40 -55.25 -47.69 75.06 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.251 0.548 . . . . 52.039999999999999 111.231 177.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -93.93 7.6 44.4 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.101 -0.499 . . . . 73.329999999999998 111.76 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.5 t30 60.11 31.39 20.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 121.424 0.63 . . . . 71.310000000000002 111.559 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.5 pt -105.54 171.69 1.82 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 121.046 0.451 . . . . 64.340000000000003 111.23 177.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.45 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 47.8 p -97.99 143.04 28.97 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-O 120.928 0.394 . . . . 74.5 111.601 -179.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.46 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 11.1 p -128.62 120.75 53.34 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.573 0 CA-C-O 121.488 0.661 . . . . 62.140000000000001 111.986 176.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 67.5 p -116.09 136.01 53.42 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.761 -0.654 . . . . 75.299999999999997 110.178 175.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 9.8 p90 -149.39 155.07 39.87 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 113.014 0.746 . . . . 75.099999999999994 113.014 -177.447 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 49.8 m -131.82 132.04 43.37 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.524 -0.762 . . . . 72.439999999999998 110.644 178.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.44 HD12 HH11 ' A' ' 54' ' ' ARG . 41.8 mm -94.15 122.11 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.575 0.226 . . . . 74.140000000000001 111.168 -179.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.585 ' HG3' ' HB2' ' A' ' 2' ' ' GLU . 14.9 ptm180 -113.53 130.85 56.27 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.482 0.658 . . . . 73.25 112.259 179.315 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.542 HD13 ' HG2' ' A' ' 1' ' ' MET . 16.7 tp -140.0 143.81 36.65 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-N 115.258 -0.883 . . . . 72.439999999999998 110.835 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -67.4 86.79 0.18 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.213 0.53 . . . . 74.209999999999994 111.002 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 21.5 p-80 -96.19 121.71 38.25 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.021 -0.536 . . . . 72.349999999999994 111.484 -176.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 37.5 p-80 -64.49 135.57 56.19 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.258 0.551 . . . . 70.209999999999994 111.185 179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 7.3 p-80 -121.9 106.33 11.15 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.061 -0.518 . . . . 73.349999999999994 111.293 -175.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 11.6 t-80 -125.17 113.36 17.58 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.991 0.424 . . . . 62.409999999999997 111.501 -177.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 -78.09 159.76 28.49 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.241 -0.436 . . . . 74.310000000000002 111.419 -179.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 60.0 t-80 . . . . . 0 C--O 1.252 1.214 0 CA-C-N 116.644 -0.253 . . . . 63.25 111.051 175.148 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.6 tmm? . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 120.826 0.346 . . . . 64.310000000000002 110.19 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -109.66 146.25 35.12 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.314 -0.403 . . . . 71.319999999999993 111.043 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.8 ptm -144.36 119.09 9.83 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 120.825 0.345 . . . . 75.329999999999998 111.928 -176.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -92.82 130.79 38.31 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 116.292 -0.413 . . . . 73.129999999999995 111.188 177.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.2 mt -132.95 112.84 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 O-C-N 122.376 -0.203 . . . . 71.030000000000001 111.38 179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 51.8 mtp180 -102.73 121.74 43.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.861 0.362 . . . . 65.439999999999998 111.765 -179.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -101.39 126.04 48.11 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.342 -0.39 . . . . 63.420000000000002 111.532 177.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -140.14 132.67 28.67 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.536 -0.302 . . . . 75.209999999999994 110.79 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.475 ' HA3' ' HB ' ' A' ' 70' ' ' ILE . . . 168.9 -173.68 43.45 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 119.977 -1.106 . . . . 75.409999999999997 114.72 178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.433 ' O ' ' HB2' ' A' ' 11' ' ' ASP . 2.5 m-20 -87.35 85.75 7.19 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.297 0.48 . . . . 65.140000000000001 112.297 -175.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.433 ' HB2' ' O ' ' A' ' 10' ' ' ASP . 8.5 t70 178.77 164.92 0.84 Allowed 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 122.968 0.507 . . . . 74.209999999999994 109.992 174.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 51.0 tp -113.76 -44.62 3.16 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-O 120.949 0.404 . . . . 54.009999999999998 111.035 178.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -63.55 -25.66 68.34 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.374 -0.376 . . . . 74.239999999999995 111.152 178.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.27 -29.03 30.85 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 120.81 0.338 . . . . 65.319999999999993 111.51 176.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.402 ' CE1' HD11 ' A' ' 37' ' ' LEU . 73.0 t80 -57.11 -60.15 4.03 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.133 0.492 . . . . 65.409999999999997 111.067 174.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.527 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 11.7 pt-20 -69.54 -38.56 77.54 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.319 -0.401 . . . . 72.510000000000005 111.567 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.443 ' HG3' ' HZ ' ' A' ' 68' ' ' PHE . 24.1 mmmt -56.75 -54.22 48.79 Favored 'General case' 0 N--CA 1.468 0.454 0 N-CA-C 112.075 0.398 . . . . 52.200000000000003 112.075 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.91 -48.22 69.36 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.919 0.39 . . . . 72.230000000000004 111.846 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 57.1 tp -63.7 -49.48 72.94 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 112.164 0.431 . . . . 53.399999999999999 112.164 -178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.0 tptp -61.37 -50.63 72.12 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 120.819 0.342 . . . . 75.540000000000006 111.672 -174.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -62.14 -43.82 98.0 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 112.0 0.37 . . . . 73.109999999999999 112.0 -178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 98.3 mmm -59.83 -45.38 92.56 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.631 0.253 . . . . 64.349999999999994 111.211 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.0 mt -63.26 -42.4 96.29 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.571 0 CA-C-O 120.96 0.41 . . . . 74.010000000000005 110.918 175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -57.28 -39.09 74.97 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 116.08 -0.509 . . . . 71.510000000000005 111.156 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -75.77 -50.2 15.94 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 112.072 0.397 . . . . 72.239999999999995 112.072 174.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.49 -38.63 84.91 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 113.009 0.744 . . . . 75.129999999999995 113.009 -175.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -26.95 58.97 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.733 0.301 . . . . 64.540000000000006 111.701 179.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -54.86 -33.09 61.41 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.198 0.523 . . . . 74.510000000000005 111.073 175.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -111.91 -168.23 1.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.953 -0.567 . . . . 72.129999999999995 111.227 -178.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.22 16.98 2.7 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 120.95 0.405 . . . . 73.519999999999996 111.778 176.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.84 108.19 2.78 Favored Glycine 0 CA--C 1.527 0.806 0 C-N-CA 121.452 -0.404 . . . . 45.049999999999997 113.331 -178.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -82.9 135.49 34.9 Favored 'General case' 0 N--CA 1.469 0.482 0 O-C-N 122.8 -0.235 . . . . 72.140000000000001 110.988 179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.6 t -113.28 125.32 70.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 N-CA-C 112.256 0.465 . . . . 71.0 112.256 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.5 t -122.57 152.5 40.35 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.129 -0.487 . . . . 61.130000000000003 110.445 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.51 ' HB2' HD11 ' A' ' 42' ' ' LEU . 38.1 p90 -144.63 141.71 29.58 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.361 0.504 . . . . 71.319999999999993 112.361 -177.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 61.0 p -133.91 135.8 43.85 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.287 -0.415 . . . . 65.209999999999994 111.152 176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.402 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.58 127.56 35.26 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-O 120.596 0.236 . . . . 61.43 111.53 179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -123.16 94.15 4.17 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.132 0.492 . . . . 74.310000000000002 111.645 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.78 -75.54 0.72 Allowed Glycine 0 CA--C 1.528 0.884 0 C-N-CA 121.303 -0.475 . . . . 73.430000000000007 113.718 174.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -139.75 11.38 2.47 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.523 0.564 . . . . 73.129999999999995 112.523 -175.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -137.47 159.97 40.43 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 121.392 0.615 . . . . 75.219999999999999 112.446 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.51 HD11 ' HB2' ' A' ' 35' ' ' TYR . 58.0 tp -105.7 119.21 38.56 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.667 -0.697 . . . . 64.340000000000003 111.823 -179.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.506 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 29.7 mt-10 -91.18 104.14 16.74 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.459 -0.337 . . . . 64.030000000000001 111.233 177.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.49 109.61 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 CA-C-O 120.691 0.281 . . . . 74.099999999999994 111.578 179.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 45' ' ' ARG . 31.1 ttp180 -110.93 125.99 54.25 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 121.076 0.465 . . . . 72.030000000000001 111.666 178.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 25.0 mt -108.12 139.53 29.97 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 CA-C-N 116.415 -0.357 . . . . 62.140000000000001 110.808 179.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 82.8 m -120.42 130.61 54.42 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 112.386 0.513 . . . . 72.049999999999997 112.386 -175.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 73.75 40.53 45.15 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 114.907 0.723 . . . . 64.430000000000007 114.907 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.8 m -95.23 152.85 39.69 Favored Pre-proline 0 N--CA 1.469 0.516 0 O-C-N 122.302 -0.529 . . . . 74.530000000000001 111.592 175.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.465 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 11.3 Cg_endo -55.11 117.16 3.72 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.779 2.319 . . . . 74.430000000000007 112.724 176.222 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -50.39 -29.97 11.29 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.955 0.724 . . . . 72.209999999999994 112.955 -178.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.457 ' O ' ' HE3' ' A' ' 55' ' ' LYS . 29.8 pt20 -76.11 -46.59 28.08 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 112.142 0.423 . . . . 73.409999999999997 112.142 179.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.465 ' HB ' ' HG2' ' A' ' 50' ' ' PRO . 58.8 t -67.61 -19.94 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 CA-C-O 121.31 0.576 . . . . 51.299999999999997 110.844 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 51' ' ' GLU . 7.0 ttp180 -46.17 -33.58 3.69 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.688 -0.687 . . . . 73.420000000000002 112.374 175.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.457 ' HE3' ' O ' ' A' ' 52' ' ' GLN . 17.1 ptpt -60.29 -45.11 94.49 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.715 0.293 . . . . 72.510000000000005 111.455 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 58.8 mm-40 -74.84 -34.15 62.27 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 120.744 0.307 . . . . 73.540000000000006 111.18 179.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 95.4 mt -63.36 -48.38 78.18 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.906 0.384 . . . . 62.340000000000003 111.248 178.507 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -68.04 -38.97 83.14 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.082 0.468 . . . . 60.420000000000002 110.982 177.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -58.77 -43.46 90.4 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.805 -0.634 . . . . 73.430000000000007 111.136 176.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -60.26 -42.35 95.17 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.124 -0.489 . . . . 73.5 110.996 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.462 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -53.84 -49.03 69.33 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 120.967 0.413 . . . . 72.510000000000005 111.618 177.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -63.34 -36.37 83.49 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-O 121.072 0.463 . . . . 52.229999999999997 111.259 177.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 15.9 tpp180 -69.08 -37.01 78.23 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.358 -0.383 . . . . 64.150000000000006 111.333 177.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.462 HD12 ' HA ' ' A' ' 61' ' ' ALA . 79.7 mt -59.57 -44.01 93.43 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.277 0.56 . . . . 54.149999999999999 110.223 174.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.88 -48.55 81.29 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 115.78 -0.646 . . . . 40.329999999999998 111.038 175.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 43.6 mmtm -60.58 -33.79 73.24 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 112.306 0.484 . . . . 72.230000000000004 112.306 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 46.2 tt0 -57.56 -36.86 72.21 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.12 0.486 . . . . 75.099999999999994 111.049 179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.443 ' HZ ' ' HG3' ' A' ' 17' ' ' LYS . 85.4 m-85 -111.05 7.06 21.34 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.204 -0.453 . . . . 74.049999999999997 111.25 177.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 55.58 28.51 11.99 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.06 0.544 . . . . 74.319999999999993 112.151 -178.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.475 ' HB ' ' HA3' ' A' ' 9' ' ' GLY . 32.2 pt -95.18 -178.25 0.44 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.744 0 N-CA-C 112.675 0.62 . . . . 74.310000000000002 112.675 -176.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 42.1 m -91.79 141.37 28.74 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.97 -0.559 . . . . 61.310000000000002 111.694 -178.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.2 p -135.41 118.71 23.8 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 CA-C-O 121.041 0.448 . . . . 63.509999999999998 111.237 174.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.3 p -115.22 120.84 41.05 Favored 'General case' 0 N--CA 1.472 0.675 0 O-C-N 122.266 -0.271 . . . . 64.340000000000003 110.469 177.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 21.8 p90 -127.92 137.3 52.24 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.301 0.572 . . . . 62.420000000000002 112.308 -175.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.0 m -113.74 111.67 22.18 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.001 -0.545 . . . . 52.130000000000003 110.822 179.575 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 49.3 mt -123.03 116.01 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-O 120.725 0.297 . . . . 65.239999999999995 111.312 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 28.3 mtp180 -117.67 119.42 34.9 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 122.522 0.329 . . . . 70.010000000000005 110.757 179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.472 HD22 ' N ' ' A' ' 78' ' ' LEU . 3.0 mm? -89.11 164.64 14.94 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.22 0.533 . . . . 65.030000000000001 112.016 -175.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.422 ' OE1' ' HB2' ' A' ' 81' ' ' HIS . 1.0 OUTLIER -75.07 147.26 40.8 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 116.185 -0.462 . . . . 64.230000000000004 110.501 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.4 p-80 -128.12 -48.52 1.33 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 112.483 0.549 . . . . 73.409999999999997 112.483 -174.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . 0.422 ' HB2' ' OE1' ' A' ' 79' ' ' GLU . 74.9 t60 50.46 25.27 1.87 Allowed 'General case' 0 N--CA 1.48 1.031 0 N-CA-C 113.775 1.028 . . . . 70.519999999999996 113.775 177.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -55.67 115.34 2.29 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.45 -0.782 . . . . 70.25 111.336 179.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 -74.15 132.45 42.24 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.018 0.437 . . . . 70.409999999999997 111.656 -176.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 34.7 p80 -108.32 -179.11 3.79 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 116.191 -0.459 . . . . 74.239999999999995 111.45 -179.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 31.3 m170 . . . . . 0 C--O 1.249 1.049 0 CA-C-O 119.017 -0.516 . . . . 75.329999999999998 110.894 174.385 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.835 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.9 mtp . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 121.01 0.433 . . . . 62.200000000000003 111.382 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.496 ' HB3' ' HB2' ' A' ' 77' ' ' ARG . 0.6 OUTLIER -122.51 119.11 29.95 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 108.791 -0.818 . . . . 74.319999999999993 108.791 178.098 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.583 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.0 ttt -124.38 122.21 37.06 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.017 1.117 . . . . 75.510000000000005 114.017 -165.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.496 ' HB3' ' O ' ' A' ' 75' ' ' THR . 1.0 OUTLIER -89.61 123.94 34.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.314 -0.857 . . . . 72.299999999999997 110.272 171.415 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 41.0 mt -130.4 108.73 16.14 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 CA-C-O 120.958 0.409 . . . . 74.5 111.257 178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.3 mtm180 -109.49 108.04 18.38 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.428 0.529 . . . . 53.5 112.428 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -89.84 156.04 18.75 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.836 -0.62 . . . . 74.140000000000001 110.708 175.169 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.537 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 42.1 ttp180 -142.42 120.4 12.06 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.171 0.51 . . . . 73.319999999999993 111.387 171.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.94 131.53 2.38 Favored Glycine 0 CA--C 1.522 0.507 0 CA-C-N 115.826 -0.625 . . . . 40.240000000000002 112.493 178.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -79.68 -5.44 55.15 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 122.427 -0.455 . . . . 64.430000000000007 111.654 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.405 ' HB2' ' HB3' ' A' ' 14' ' ' ALA . 9.6 m-20 -73.02 101.22 3.18 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 120.954 0.407 . . . . 73.010000000000005 110.709 174.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.415 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 30.4 tp -61.97 -26.98 68.53 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.046 0.387 . . . . 74.230000000000004 112.046 -175.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.2 pp20? -73.44 -36.35 65.89 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 122.024 -0.423 . . . . 73.400000000000006 110.527 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.405 ' HB3' ' HB2' ' A' ' 11' ' ' ASP . . . -66.74 -31.75 72.6 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 120.893 0.378 . . . . 73.099999999999994 110.819 175.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.451 ' HE1' HD13 ' A' ' 42' ' ' LEU . 60.6 t80 -55.26 -48.17 74.38 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.114 0.483 . . . . 75.209999999999994 110.331 171.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 20' ' ' LYS . 9.0 tm-20 -60.45 -50.42 73.66 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.824 -0.626 . . . . 74.109999999999999 110.86 176.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -56.63 -54.35 47.12 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 112.403 0.52 . . . . 74.319999999999993 112.403 -179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.517 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -56.17 -53.36 58.06 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 111.891 0.33 . . . . 70.200000000000003 111.891 -177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 49.8 tp -62.48 -36.74 83.45 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-O 121.061 0.458 . . . . 73.519999999999996 110.786 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.471 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 15.9 tptm -59.03 -51.05 71.72 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 116.041 -0.527 . . . . 72.340000000000003 111.73 -179.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.577 ' HG3' HD21 ' A' ' 64' ' ' LEU . 7.8 mm-40 -61.65 -47.52 85.0 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.913 -0.585 . . . . 72.530000000000001 111.82 -178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.521 ' HB3' HD11 ' A' ' 46' ' ' ILE . 51.3 mmm -61.88 -40.38 95.21 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.781 0.324 . . . . 74.310000000000002 111.301 -179.086 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.0 mt -67.79 -37.58 78.77 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-O 120.787 0.327 . . . . 72.209999999999994 110.867 174.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.483 HH21 ' CD ' ' A' ' 21' ' ' GLU . 60.2 ttp85 -54.91 -42.5 72.25 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-O 120.884 0.373 . . . . 74.310000000000002 111.094 176.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 29.9 mm-40 -74.19 -48.04 31.73 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 120.951 0.405 . . . . 72.430000000000007 111.509 175.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.77 -46.66 71.04 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.752 0.649 . . . . 71.450000000000003 112.752 -175.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -56.4 -34.3 66.61 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.603 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 28.1 mtpp -72.84 -32.63 65.61 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.072 0.463 . . . . 63.340000000000003 111.372 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.43 ' CZ ' HG11 ' A' ' 53' ' ' VAL . 24.9 m-85 -96.35 -6.28 38.03 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 116.321 -0.399 . . . . 74.349999999999994 111.854 -179.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 62.12 27.21 16.4 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.126 0.489 . . . . 64.099999999999994 111.516 -176.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -81.94 156.87 36.75 Favored Glycine 0 CA--C 1.527 0.802 0 CA-C-N 116.126 -0.488 . . . . 74.120000000000005 113.262 -178.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 78.0 m -88.32 128.66 35.49 Favored 'General case' 0 N--CA 1.472 0.638 0 O-C-N 122.731 -0.276 . . . . 74.219999999999999 110.949 178.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.509 HG22 HG12 ' A' ' 46' ' ' ILE . 61.1 t -123.78 114.47 41.58 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 121.047 0.451 . . . . 75.129999999999995 112.054 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.8 t -106.53 154.4 20.93 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.274 -0.421 . . . . 70.430000000000007 110.464 173.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.593 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 41.1 p90 -145.67 138.08 25.66 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 121.094 0.473 . . . . 74.230000000000004 112.144 -178.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 54.8 p -132.9 134.43 44.56 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.119 -0.491 . . . . 74.519999999999996 111.049 178.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.57 100.91 12.32 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.777 0.322 . . . . 52.549999999999997 111.133 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -97.61 97.58 9.17 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.828 0.346 . . . . 73.040000000000006 110.864 179.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.64 -78.04 0.13 Allowed Glycine 0 CA--C 1.529 0.924 0 C-N-CA 121.357 -0.449 . . . . 62.240000000000002 113.055 -179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -143.31 15.81 1.86 Allowed 'General case' 0 CA--C 1.541 0.624 0 O-C-N 122.541 -0.388 . . . . 74.120000000000005 111.342 177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.452 ' OD2' ' HD3' ' A' ' 8' ' ' ARG . 3.9 m-20 -107.17 128.67 54.61 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.217 -0.447 . . . . 74.450000000000003 111.211 177.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.451 HD13 ' HE1' ' A' ' 15' ' ' PHE . 46.8 tp -95.5 101.72 13.46 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-O 121.278 0.561 . . . . 54.229999999999997 111.358 177.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.593 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.7 tt0 -89.53 107.18 18.93 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.108 -0.497 . . . . 74.530000000000001 111.642 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.8 mt -113.07 117.62 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 122.624 0.369 . . . . 71.349999999999994 110.88 178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.478 ' HG2' ' HA ' ' A' ' 4' ' ' ASP . 74.0 mtt180 -116.86 122.92 45.75 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.823 -0.548 . . . . 71.019999999999996 111.865 -179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 22' ' ' MET . 51.2 mt -110.0 115.06 48.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.995 -0.548 . . . . 71.120000000000005 111.593 -176.162 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.44 HG23 ' HG2' ' A' ' 2' ' ' GLU . 60.4 m -100.48 127.01 46.94 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.116 -0.493 . . . . 74.230000000000004 111.548 -179.614 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.43 57.29 1.13 Allowed Glycine 0 CA--C 1.527 0.794 0 C-N-CA 121.152 -0.547 . . . . 62.439999999999998 113.627 175.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.515 HG23 ' HB2' ' A' ' 1' ' ' MET . 18.5 m -118.11 138.73 25.81 Favored Pre-proline 0 CA--C 1.541 0.63 0 CA-C-O 120.748 0.309 . . . . 52.310000000000002 111.445 177.113 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.462 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 16.8 Cg_exo -68.14 140.46 49.49 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 123.008 2.472 . . . . 75.430000000000007 113.389 -177.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.835 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 11.6 pt-20 -54.64 -41.08 69.63 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 112.73 0.641 . . . . 44.43 112.73 -178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -66.14 -24.09 66.6 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.271 0.471 . . . . 73.549999999999997 112.271 -179.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.528 HG12 ' HG ' ' A' ' 57' ' ' LEU . 40.1 t -84.53 -10.19 11.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.774 0 CA-C-O 120.912 0.387 . . . . 75.040000000000006 111.684 -177.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' HD12 ' A' ' 76' ' ' ILE . 4.1 tpt180 -43.73 -45.17 6.99 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.641 0.377 . . . . 72.439999999999998 111.989 175.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -63.96 -31.44 72.62 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 116.157 -0.474 . . . . 73.230000000000004 111.836 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -77.07 -53.85 7.27 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.873 0.368 . . . . 70.510000000000005 111.694 176.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.528 ' HG ' HG12 ' A' ' 53' ' ' VAL . 82.5 mt -56.0 -53.52 55.9 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.582 0.586 . . . . 75.310000000000002 112.582 -174.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -65.18 -40.6 94.5 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.966 0.413 . . . . 51.420000000000002 111.51 -178.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -62.66 -40.94 98.62 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.319 -0.4 . . . . 71.030000000000001 111.539 177.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -74.2 -34.8 63.84 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-O 120.826 0.346 . . . . 75.310000000000002 111.262 179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.71 -47.49 85.43 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.911 0.386 . . . . 55.109999999999999 110.879 174.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -67.48 -31.47 71.63 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.43 -0.35 . . . . 73.120000000000005 111.34 175.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 24.1 ttp180 -55.59 -53.37 57.35 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.981 -0.377 . . . . 74.420000000000002 109.981 174.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.577 HD21 ' HG3' ' A' ' 21' ' ' GLU . 54.4 mt -49.87 -43.08 49.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.925 -0.579 . . . . 64.239999999999995 112.047 178.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -60.85 -57.39 12.88 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.001 0.429 . . . . 44.409999999999997 111.577 178.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -69.6 -28.21 65.74 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 120.999 0.428 . . . . 44.210000000000001 111.828 -177.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -75.73 -36.99 59.78 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.07 0.548 . . . . 70.099999999999994 111.805 -176.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -111.56 7.49 20.63 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 120.896 0.379 . . . . 64.010000000000005 111.883 178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 66.24 13.38 9.14 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.36 0.664 . . . . 75.319999999999993 112.088 176.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.7 pt -88.64 178.26 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 CA-C-N 116.55 -0.295 . . . . 63.119999999999997 111.186 178.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.537 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 57.0 p -107.1 156.06 19.19 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.063 0.459 . . . . 72.129999999999995 112.144 -179.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 11.1 p -147.78 131.8 9.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 CA-C-O 121.35 0.595 . . . . 71.150000000000006 111.686 178.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.8 p -132.05 121.76 24.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.154 -0.475 . . . . 72.109999999999999 110.072 174.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 38.5 p90 -129.49 130.06 45.36 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 112.903 0.705 . . . . 73.400000000000006 112.903 -176.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.496 ' O ' ' HB3' ' A' ' 4' ' ' ASP . 68.3 m -113.84 121.91 45.45 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 115.683 -0.689 . . . . 54.020000000000003 110.783 175.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.583 HG12 ' HG3' ' A' ' 3' ' ' MET . 25.1 mt -101.08 126.83 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.128 0.49 . . . . 72.319999999999993 112.306 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 2' ' ' GLU . 26.0 mmm180 -75.4 100.65 4.51 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 116.129 -0.487 . . . . 71.219999999999999 110.917 175.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.5 tt -123.7 114.2 19.63 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.982 0.42 . . . . 73.319999999999993 109.993 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -71.79 134.11 45.96 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.442 0.534 . . . . 70.040000000000006 112.442 -177.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -71.33 89.0 0.88 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 109.403 -0.591 . . . . 45.32 109.403 172.564 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 11.9 t60 -75.45 1.09 14.92 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 113.254 0.835 . . . . 73.140000000000001 113.254 -166.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -123.13 91.55 3.51 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 122.137 -0.352 . . . . 70.409999999999997 110.268 171.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -59.26 -50.17 75.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 116.371 -0.377 . . . . 75.230000000000004 111.823 -172.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -71.26 97.98 1.66 Allowed 'General case' 0 CA--C 1.545 0.768 0 CA-C-O 121.054 0.454 . . . . 70.129999999999995 111.66 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 . . . . . 0 C--O 1.256 1.423 0 C-N-CA 123.374 0.67 . . . . 62.25 112.557 -177.983 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.578 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 69.3 mtm . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 120.836 0.351 . . . . 70.299999999999997 111.707 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.74 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 40.2 mt-10 -95.2 132.92 39.63 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 109.711 -0.477 . . . . 72.340000000000003 109.711 170.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.504 ' O ' ' HA ' ' A' ' 45' ' ' ARG . 23.8 ttt -114.49 106.54 14.4 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.988 0.423 . . . . 70.430000000000007 110.23 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.493 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 12.5 t70 -99.67 108.44 20.8 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.197 -0.456 . . . . 35.340000000000003 111.241 -172.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 58.6 mt -127.83 111.81 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 116.426 -0.352 . . . . 73.349999999999994 110.654 177.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.4 ptp180 -118.32 119.79 35.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.343 0.592 . . . . 75.510000000000005 112.265 -176.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -94.17 155.53 17.01 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.802 -0.635 . . . . 73.209999999999994 111.237 178.317 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 ttm180 -124.13 120.02 31.13 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.888 0.375 . . . . 75.049999999999997 110.192 168.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -120.9 135.36 10.71 Favored Glycine 0 CA--C 1.527 0.801 0 C-N-CA 120.945 -0.645 . . . . 74.209999999999994 113.306 -175.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -73.41 -43.68 59.97 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 120.849 0.357 . . . . 72.140000000000001 111.667 177.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -88.58 -171.48 3.35 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.067 0.46 . . . . 74.230000000000004 112.124 -178.574 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 54.1 tp -95.93 -52.55 4.01 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 112.545 0.572 . . . . 74.340000000000003 112.545 -176.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -61.58 -26.75 68.16 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 112.932 0.716 . . . . 64.439999999999998 112.932 -172.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.5 -30.98 44.01 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.978 0.418 . . . . 43.119999999999997 111.026 177.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -59.77 -57.8 11.33 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.845 -0.616 . . . . 71.040000000000006 111.365 174.132 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -66.59 -51.16 59.48 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 112.131 0.419 . . . . 64.329999999999998 112.131 -177.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.5 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 35.8 mmtp -55.27 -54.31 45.14 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 116.435 -0.348 . . . . 75.129999999999995 111.721 -176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.72 -51.99 59.49 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.972 0.36 . . . . 63.25 111.972 -178.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.488 ' HB2' HD21 ' A' ' 42' ' ' LEU . 67.2 tp -55.88 -48.53 75.41 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.369 -0.378 . . . . 72.120000000000005 111.822 -178.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -62.35 -40.84 97.71 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 112.248 0.462 . . . . 62.140000000000001 112.248 -176.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 18.6 mm-40 -60.05 -51.56 69.1 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 120.624 0.25 . . . . 71.510000000000005 111.174 178.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.4 mtp -59.38 -44.57 92.75 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.019 0.438 . . . . 72.310000000000002 111.268 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 54.0 mt -60.37 -37.15 73.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 116.407 -0.36 . . . . 62.399999999999999 111.219 176.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 12.0 ttm180 -57.73 -53.38 58.89 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-O 120.836 0.35 . . . . 75.239999999999995 111.397 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -68.55 -41.61 79.54 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 111.852 0.316 . . . . 63.140000000000001 111.852 178.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -63.62 -43.5 96.68 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.736 0.643 . . . . 74.239999999999995 112.736 -176.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 27' ' ' ARG . 28.5 mtp85 -60.04 -27.53 67.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.626 0.602 . . . . 72.239999999999995 112.626 -178.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -58.16 -23.95 57.14 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.399 0.618 . . . . 70.430000000000007 110.965 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 60.7 m-85 -114.21 -164.6 0.94 Allowed 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.949 -0.569 . . . . 72.219999999999999 110.706 178.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.11 9.83 11.65 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-O 120.88 0.371 . . . . 53.219999999999999 111.599 176.066 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -67.25 86.95 0.14 Allowed Glycine 0 CA--C 1.525 0.716 0 CA-C-N 116.198 -0.456 . . . . 71.439999999999998 113.589 -176.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.5 m -71.55 117.03 12.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.806 0.336 . . . . 71.530000000000001 110.963 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 56.6 t -99.19 125.23 52.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 N-CA-C 112.38 0.511 . . . . 64.450000000000003 112.38 -175.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.1 t -121.14 138.53 54.16 Favored 'General case' 0 N--CA 1.471 0.592 0 CA-C-N 116.302 -0.408 . . . . 74.219999999999999 110.799 173.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.558 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.2 p90 -134.19 137.15 44.22 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.366 0.506 . . . . 75.049999999999997 112.366 -175.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.4 p -124.35 138.96 54.32 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 116.198 -0.455 . . . . 72.129999999999995 111.187 176.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -108.08 131.6 54.43 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.045 0.45 . . . . 51.5 111.918 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -145.01 119.96 9.99 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.294 -0.412 . . . . 53.130000000000003 110.588 174.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.53 -86.72 0.07 OUTLIER Glycine 0 CA--C 1.526 0.768 0 C-N-CA 121.105 -0.569 . . . . 73.510000000000005 112.99 -179.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.4 p-10 -144.92 10.77 1.36 Allowed 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.042 0.449 . . . . 71.319999999999993 111.45 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -95.32 122.78 38.38 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 116.165 -0.47 . . . . 74.329999999999998 111.514 178.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.488 HD21 ' HB2' ' A' ' 19' ' ' LEU . 33.6 tp -96.45 103.92 15.86 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 116.138 -0.483 . . . . 65.400000000000006 110.578 173.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.558 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 33.2 mt-10 -90.08 104.46 17.03 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 116.353 -0.385 . . . . 75.519999999999996 111.464 -177.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -105.24 109.46 27.79 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.592 0 CA-C-O 120.73 0.3 . . . . 74.299999999999997 111.451 -179.015 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.504 ' HA ' ' O ' ' A' ' 3' ' ' MET . 37.9 ttm180 -111.82 115.27 28.76 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.86 -0.525 . . . . 75.420000000000002 111.364 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 44.7 mt -92.99 137.03 23.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 116.206 -0.452 . . . . 72.219999999999999 110.508 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 50.9 m -125.51 125.2 42.88 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 111.862 0.319 . . . . 62.439999999999998 111.862 -175.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 86.16 58.93 1.91 Allowed Glycine 0 CA--C 1.533 1.18 0 C-N-CA 121.362 -0.447 . . . . 72.5 114.143 176.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 18.5 m -117.16 144.63 34.1 Favored Pre-proline 0 N--CA 1.474 0.735 0 O-C-N 122.248 -0.56 . . . . 74.010000000000005 111.912 178.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_endo -61.66 130.73 32.57 Favored 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 122.412 2.075 . . . . 71.120000000000005 111.626 173.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -57.18 -28.58 62.94 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.533 0.938 . . . . 72.349999999999994 113.533 -170.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -68.1 -38.01 81.81 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 122.062 -0.399 . . . . 73.450000000000003 111.287 176.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 60.3 t -77.69 -27.23 15.28 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 121.129 0.49 . . . . 64.299999999999997 110.89 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.578 ' NH1' ' SD ' ' A' ' 1' ' ' MET . 50.3 ttp180 -49.0 -38.7 24.09 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 115.74 -0.664 . . . . 71.329999999999998 111.517 176.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -60.18 -49.09 79.01 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.166 -0.47 . . . . 74.400000000000006 111.751 177.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.1 mm-40 -66.98 -41.51 86.68 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 116.08 -0.509 . . . . 64.299999999999997 112.285 -176.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 93.1 mt -61.33 -42.96 99.54 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 120.864 0.364 . . . . 63.100000000000001 111.312 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -64.3 -43.36 94.95 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.224 0.535 . . . . 72.439999999999998 111.138 176.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -67.93 -31.14 70.69 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.836 -0.62 . . . . 64.329999999999998 111.541 179.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -70.77 -33.32 70.65 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.977 0.418 . . . . 63.420000000000002 110.39 175.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.07 -44.4 91.87 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-O 121.121 0.486 . . . . 52.020000000000003 110.925 173.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -59.95 -41.74 92.5 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 121.353 0.596 . . . . 71.129999999999995 110.534 174.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -57.16 -48.99 77.34 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.76 -0.654 . . . . 75.450000000000003 111.087 176.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 97.0 mt -58.57 -40.23 82.5 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 116.174 -0.466 . . . . 74.219999999999999 111.392 177.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.45 -49.01 78.86 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 116.192 -0.458 . . . . 64.219999999999999 111.279 176.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.14 -33.82 76.92 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.938 0.399 . . . . 72.140000000000001 111.271 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 12.8 tp10 -62.39 -55.24 29.78 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.186 -0.461 . . . . 75.109999999999999 111.489 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 -93.24 2.52 56.59 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.272 0.471 . . . . 73.540000000000006 112.272 -177.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.1 m120 58.63 31.87 21.56 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.068 0.461 . . . . 74.519999999999996 111.297 -179.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 29.2 pt -103.88 171.55 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 CA-C-O 121.148 0.499 . . . . 62.240000000000002 112.004 -177.16 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 97.7 m -98.49 141.37 31.43 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 116.106 -0.497 . . . . 53.030000000000001 111.301 177.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 7.3 p -147.54 142.99 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.57 0 CA-C-N 116.41 -0.359 . . . . 72.450000000000003 111.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.1 p -118.71 147.88 43.36 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 120.751 0.31 . . . . 43.43 110.78 173.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.493 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.4 p90 -143.82 123.9 13.65 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.122 0.487 . . . . 72.25 111.969 -176.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.9 m -131.81 143.61 50.32 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 116.381 -0.372 . . . . 65.219999999999999 111.4 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 43.5 mm -100.31 105.66 17.99 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.646 0 CA-C-O 121.197 0.522 . . . . 65.109999999999999 111.545 -179.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.74 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 19.6 mtp180 -83.52 104.95 14.07 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-O 121.328 0.585 . . . . 63.539999999999999 111.209 178.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.572 HD22 ' HG2' ' A' ' 1' ' ' MET . 1.5 tm? -91.77 111.96 23.69 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.985 -0.552 . . . . 72.030000000000001 110.763 -177.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -92.41 130.4 38.1 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 120.845 0.355 . . . . 73.400000000000006 111.101 174.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 64.6 t60 178.97 123.45 0.05 Allowed 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.686 -0.688 . . . . 74.209999999999994 110.35 -176.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.7 t-80 -61.27 96.31 0.05 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.193 0.521 . . . . 74.019999999999996 111.761 -178.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 56.2 t-80 -102.67 120.45 40.59 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 116.063 -0.517 . . . . 64.5 110.461 174.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 84.4 t60 -59.66 102.77 0.16 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 121.028 0.442 . . . . 63.219999999999999 111.344 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 73.6 t60 -69.53 137.2 52.27 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.185 -0.461 . . . . 74.120000000000005 111.507 178.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--O 1.254 1.317 0 CA-C-O 118.752 -0.642 . . . . 74.310000000000002 111.382 175.551 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 tmm? . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 110.298 -0.26 . . . . 51.439999999999998 110.298 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.549 ' HG2' HG23 ' A' ' 47' ' ' THR . 36.3 mt-10 -135.88 140.99 44.53 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 122.864 0.466 . . . . 70.510000000000005 110.714 -177.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 14.8 ptm -144.23 120.06 10.57 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.202 0.445 . . . . 74.5 112.202 -177.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.626 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 29.4 m-20 -90.67 104.63 17.19 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.548 -0.296 . . . . 64.030000000000001 110.919 176.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.3 mt -103.8 109.2 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 CA-C-O 120.726 0.298 . . . . 62.009999999999998 110.936 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 4.8 ptp180 -108.47 125.61 51.97 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.256 0.55 . . . . 74.120000000000005 112.26 -179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -102.85 132.06 49.31 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.475 -0.784 . . . . 52.130000000000003 111.371 178.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 48.4 ttp180 -142.94 119.9 11.32 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 120.578 0.228 . . . . 71.209999999999994 110.665 174.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -173.86 160.28 30.22 Favored Glycine 0 CA--C 1.526 0.761 0 C-N-CA 120.826 -0.702 . . . . 74.450000000000003 113.312 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -86.3 89.05 7.74 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 120.968 0.414 . . . . 75.439999999999998 112.006 -177.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -165.33 165.64 19.27 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 116.067 -0.515 . . . . 74.219999999999999 109.996 173.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -106.85 -52.16 2.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 120.673 0.273 . . . . 65.120000000000005 111.6 -179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -71.58 -25.6 62.26 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.313 0.486 . . . . 54.130000000000003 112.313 -178.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.53 -30.17 40.37 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 112.078 0.399 . . . . 72.109999999999999 112.078 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CE1' HD21 ' A' ' 37' ' ' LEU . 59.7 t80 -58.96 -60.22 4.21 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.821 0.343 . . . . 71.420000000000002 111.178 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -57.74 -44.4 86.02 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.225 -0.443 . . . . 64.439999999999998 111.285 177.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -58.11 -56.13 26.03 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 116.081 -0.509 . . . . 62.100000000000001 112.084 179.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.06 -44.33 96.13 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 121.119 0.485 . . . . 52.450000000000003 111.624 -177.007 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.44 ' O ' HG13 ' A' ' 23' ' ' ILE . 45.0 tp -62.09 -56.16 21.69 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.93 -0.577 . . . . 63.409999999999997 111.779 -179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -63.09 -41.21 99.34 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.127 0.417 . . . . 52.200000000000003 112.127 -175.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -54.97 -47.72 74.2 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.609 0.242 . . . . 71.329999999999998 111.515 179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 45.0 mtp -72.77 -36.39 67.65 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-O 120.667 0.27 . . . . 74.400000000000006 111.552 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 19' ' ' LEU . 63.7 mt -57.29 -34.53 46.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-O 120.739 0.304 . . . . 75.5 111.274 175.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 24' ' ' ARG . 37.1 ttp180 -48.92 -46.72 43.45 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 116.304 -0.407 . . . . 71.209999999999994 111.577 176.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -74.46 -43.54 55.67 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.633 0.254 . . . . 73.019999999999996 111.297 174.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.08 -34.57 63.74 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.639 0.607 . . . . 71.510000000000005 112.639 -177.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.491 ' HE ' ' HA ' ' A' ' 27' ' ' ARG . 6.5 mmp_? -60.53 -28.98 68.83 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 120.759 0.314 . . . . 72.299999999999997 111.65 178.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.408 ' HE3' ' N ' ' A' ' 28' ' ' LYS . 0.6 OUTLIER -74.61 -13.22 60.62 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.412 0.285 . . . . 62.0 111.746 178.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -111.73 151.54 28.81 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-O 121.211 0.529 . . . . 73.030000000000001 112.043 -177.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -99.21 57.05 1.05 Allowed 'General case' 0 CA--C 1.541 0.629 0 CA-C-O 121.015 0.436 . . . . 63.020000000000003 111.233 176.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -123.52 -168.26 12.98 Favored Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.344 -0.455 . . . . 52.509999999999998 113.491 -177.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 95.8 m -103.83 127.83 51.3 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 122.619 -0.342 . . . . 73.439999999999998 111.751 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 58.7 t -131.84 110.84 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 CA-C-O 120.756 0.312 . . . . 74.409999999999997 110.705 175.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.3 t -121.76 162.5 20.73 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.922 0.391 . . . . 61.119999999999997 111.767 -179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.595 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 30.3 p90 -156.41 139.44 15.42 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 116.236 -0.438 . . . . 73.409999999999997 111.083 -178.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 t -137.09 133.75 35.71 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 112.573 0.582 . . . . 73.140000000000001 112.573 179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.403 HD21 ' CE1' ' A' ' 15' ' ' PHE . 3.6 mm? -94.19 102.21 14.23 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.072 -0.513 . . . . 70.239999999999995 110.99 176.31 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -118.27 106.0 12.33 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.065 0.459 . . . . 73.329999999999998 111.013 179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.54 -85.22 0.44 Allowed Glycine 0 CA--C 1.525 0.695 0 C-N-CA 121.208 -0.52 . . . . 55.0 112.808 179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.2 p-10 -146.14 15.39 1.33 Allowed 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 120.763 0.316 . . . . 74.400000000000006 111.545 178.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -117.66 130.28 56.26 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.47 -0.332 . . . . 71.200000000000003 110.856 179.434 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.455 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 48.8 tp -102.94 102.6 12.68 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.437 -0.347 . . . . 73.030000000000001 111.271 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.595 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 27.3 mm-40 -87.97 106.57 18.21 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 116.515 -0.311 . . . . 50.030000000000001 111.177 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.41 HD11 HD21 ' A' ' 42' ' ' LEU . 54.1 mt -111.69 110.23 31.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 CA-C-O 120.557 0.218 . . . . 73.120000000000005 111.001 177.114 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 39.3 ttt85 -107.1 122.6 46.8 Favored 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.945 -0.472 . . . . 73.420000000000002 111.721 -179.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 50.5 mt -106.89 127.84 62.16 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 CA-C-N 116.094 -0.503 . . . . 73.140000000000001 110.407 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.549 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -130.14 128.41 41.73 Favored 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.284 0.476 . . . . 71.230000000000004 112.284 -174.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 92.82 32.55 7.93 Favored Glycine 0 CA--C 1.53 0.976 0 N-CA-C 114.613 0.605 . . . . 45.0 114.613 172.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 36.0 m -111.67 141.44 24.65 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-N 117.506 0.653 . . . . 64.439999999999998 111.326 176.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.491 ' HB2' ' HG2' ' A' ' 52' ' ' GLN . 21.2 Cg_endo -59.14 133.62 54.21 Favored 'Trans proline' 0 CA--C 1.54 0.818 0 C-N-CA 122.797 2.331 . . . . 73.150000000000006 112.974 -178.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -59.58 -25.35 64.52 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.354 0.501 . . . . 71.420000000000002 112.354 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 50' ' ' PRO . 29.0 pt20 -60.34 -34.09 73.34 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 120.76 0.314 . . . . 75.129999999999995 111.743 177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.456 HG23 ' HG3' ' A' ' 52' ' ' GLN . 42.9 t -91.49 -24.42 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 CA-C-O 121.001 0.429 . . . . 75.209999999999994 110.827 178.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.624 ' HD3' HD13 ' A' ' 76' ' ' ILE . 5.9 tmm_? -47.88 -41.82 25.27 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.016 0.527 . . . . 64.420000000000002 111.49 178.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 21.4 ptmt -61.2 -42.51 98.72 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 120.872 0.368 . . . . 74.439999999999998 111.81 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -66.0 -45.39 81.75 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-O 120.883 0.373 . . . . 72.530000000000001 110.684 178.26 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.34 -43.68 83.61 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.143 0.497 . . . . 72.420000000000002 111.247 177.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.446 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -64.07 -46.21 85.32 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 116.072 -0.513 . . . . 72.239999999999995 111.719 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.4 ttmm -71.64 -34.19 69.56 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 112.19 0.441 . . . . 73.019999999999996 112.19 -177.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -63.95 -37.16 86.39 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 121.169 0.509 . . . . 70.030000000000001 109.988 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.535 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -63.51 -38.79 92.48 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-N 115.889 -0.596 . . . . 64.099999999999994 111.163 173.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 45.5 mt-10 -58.07 -40.89 82.19 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.858 0.361 . . . . 75.549999999999997 110.968 175.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -61.24 -44.43 97.26 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.653 -0.249 . . . . 74.450000000000003 111.032 176.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.535 HD12 ' HA ' ' A' ' 61' ' ' ALA . 81.4 mt -50.46 -40.85 51.95 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.076 0.465 . . . . 75.439999999999998 111.127 177.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.613 ' HB2' HG12 ' A' ' 72' ' ' VAL . . . -65.8 -56.85 9.78 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.198 -0.455 . . . . 53.229999999999997 111.73 176.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -65.35 -23.92 67.11 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 116.19 -0.459 . . . . 72.019999999999996 112.087 -177.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -82.44 -56.23 4.01 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.1 0.476 . . . . 74.409999999999997 111.431 -179.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.2 m-85 -94.05 4.61 53.66 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 112.153 0.427 . . . . 73.510000000000005 112.153 -175.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 61.81 20.26 11.29 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 112.439 0.533 . . . . 61.219999999999999 112.439 179.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 23.8 pt -90.17 153.13 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 CA-C-N 116.282 -0.417 . . . . 63.039999999999999 111.366 179.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.5 m -87.98 122.22 31.32 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.257 -0.277 . . . . 74.230000000000004 111.252 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.613 HG12 ' HB2' ' A' ' 65' ' ' ALA . 12.5 p -123.88 133.62 68.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-O 121.26 0.552 . . . . 71.219999999999999 111.591 178.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 40.6 p -142.62 142.02 32.04 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 116.219 -0.446 . . . . 72.109999999999999 110.713 176.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.626 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 13.6 p90 -137.24 128.59 28.14 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.822 0.675 . . . . 73.049999999999997 112.822 -176.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 62.4 m -102.78 123.86 47.23 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 115.89 -0.596 . . . . 72.230000000000004 110.197 174.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.624 HD13 ' HD3' ' A' ' 54' ' ' ARG . 34.3 mt -122.99 139.46 49.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.78 0.659 . . . . 51.219999999999999 112.78 -169.525 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.453 HH11 ' HD2' ' A' ' 77' ' ' ARG . 14.0 ptm180 -143.22 173.31 11.7 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.982 -0.554 . . . . 75.349999999999994 110.781 174.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 pp -156.84 167.39 30.6 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.105 0.479 . . . . 63.020000000000003 111.884 178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.431 ' CD ' ' H ' ' A' ' 79' ' ' GLU . 1.2 pm0 -75.83 85.19 2.8 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.288 0.566 . . . . 73.120000000000005 110.775 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -57.9 105.74 0.29 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.937 -0.574 . . . . 74.540000000000006 111.223 -177.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -53.59 113.55 1.22 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 113.322 0.86 . . . . 74.340000000000003 113.322 -171.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 63.6 m170 -110.23 -177.0 3.13 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 116.22 -0.446 . . . . 75.129999999999995 110.664 174.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -165.24 138.66 4.62 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 112.166 0.432 . . . . 62.340000000000003 112.166 176.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 33.7 t-80 -78.55 144.79 35.27 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 116.034 -0.53 . . . . 70.019999999999996 110.654 174.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.7 m80 . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.856 -0.593 . . . . 71.109999999999999 111.919 179.041 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.452 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 47.8 ttp . . . . . 0 N--CA 1.487 1.408 0 CA-C-O 120.562 0.22 . . . . 72.299999999999997 110.826 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -125.8 153.51 43.95 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 112.245 0.461 . . . . 73.319999999999993 112.245 -175.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -148.29 112.14 5.11 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 115.951 -0.568 . . . . 73.120000000000005 110.979 175.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.581 ' HB3' ' HG2' ' A' ' 45' ' ' ARG . 2.3 p-10 -99.11 119.8 38.44 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 121.525 0.678 . . . . 74.510000000000005 111.866 179.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.515 HD13 ' HB2' ' A' ' 61' ' ' ALA . 56.4 mt -111.61 114.83 48.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 CA-C-N 115.98 -0.555 . . . . 73.030000000000001 111.576 -177.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.411 ' HD3' ' OD2' ' A' ' 41' ' ' ASP . 1.3 tmm_? -101.13 112.52 25.01 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 120.987 0.423 . . . . 73.040000000000006 111.549 -177.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.441 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 97.8 m-85 -91.19 156.04 18.14 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.75 0.309 . . . . 62.399999999999999 111.555 176.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.451 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 65.1 ttt180 -139.91 121.52 15.25 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 116.586 -0.279 . . . . 73.25 111.206 177.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.25 163.82 36.73 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 121.164 -0.541 . . . . 53.329999999999998 113.262 178.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -87.31 -35.74 18.25 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.946 0.403 . . . . 73.340000000000003 111.525 178.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -61.7 119.68 9.18 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.047 -0.524 . . . . 73.439999999999998 112.036 -177.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 56.9 tp -61.95 -39.86 93.57 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 121.076 0.465 . . . . 71.219999999999999 110.87 177.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.49 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 1.8 mp0 -61.9 -27.88 69.13 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 116.091 -0.504 . . . . 74.329999999999998 111.744 177.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' A' ' 70' ' ' ILE . . . -58.97 -39.65 82.38 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.828 0.347 . . . . 75.540000000000006 111.13 177.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 68.1 m-85 -67.89 -53.92 22.85 Favored 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 116.33 -0.396 . . . . 75.519999999999996 111.642 -179.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 11.0 pt-20 -62.38 -42.56 99.51 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.1 0.407 . . . . 51.130000000000003 112.1 -177.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.499 ' HB3' ' NZ ' ' A' ' 17' ' ' LYS . 4.2 mmmp? -65.29 -42.62 92.93 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 122.296 -0.252 . . . . 74.25 111.437 178.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.525 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -62.24 -47.54 83.93 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.209 0.528 . . . . 72.019999999999996 111.432 178.314 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 44.9 tp -62.14 -43.99 97.61 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 115.975 -0.557 . . . . 63.450000000000003 111.146 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -60.95 -48.31 82.4 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 116.246 -0.434 . . . . 74.340000000000003 111.593 -178.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 65.5 mm-40 -57.95 -53.21 60.75 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 111.915 0.339 . . . . 73.140000000000001 111.915 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.418 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.3 mmm -59.55 -48.6 81.03 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.774 0.321 . . . . 72.519999999999996 111.704 -177.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.608 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 56.8 mt -64.64 -42.77 96.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.526 0 N-CA-C 111.764 0.283 . . . . 64.129999999999995 111.764 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -51.66 -47.44 63.79 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 120.727 0.299 . . . . 74.140000000000001 111.666 -177.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -72.14 -44.23 63.45 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 120.83 0.348 . . . . 71.409999999999997 111.315 175.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.57 -31.46 69.47 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 113.003 0.742 . . . . 74.510000000000005 113.003 -176.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 79.5 mtp180 -58.88 -28.47 66.17 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.023 0.379 . . . . 74.150000000000006 112.023 -179.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.448 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -70.41 -13.56 62.19 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.962 0.41 . . . . 73.109999999999999 111.391 178.366 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -114.13 117.72 32.01 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.454 -0.339 . . . . 74.5 110.663 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.49 87.85 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 112.782 0.66 . . . . 74.549999999999997 112.782 -175.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.31 -153.8 6.23 Favored Glycine 0 CA--C 1.527 0.792 0 CA-C-N 115.939 -0.573 . . . . 74.439999999999998 112.461 177.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 54.3 m -148.09 136.0 21.02 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-O 120.758 0.313 . . . . 63.329999999999998 111.188 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.1 t -117.42 124.76 73.46 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-O 120.994 0.426 . . . . 75.319999999999993 111.545 179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.1 t -117.79 153.54 33.27 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 116.389 -0.369 . . . . 53.530000000000001 110.281 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.483 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 37.6 p90 -141.8 141.93 33.18 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 112.61 0.596 . . . . 71.109999999999999 112.61 -173.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 43' ' ' GLU . 17.2 m -119.18 123.36 44.15 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 116.091 -0.504 . . . . 72.25 111.14 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -100.46 121.54 41.72 Favored 'General case' 0 N--CA 1.475 0.787 0 CA-C-O 120.575 0.226 . . . . 73.230000000000004 111.203 177.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -134.73 84.53 2.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.093 0.473 . . . . 71.010000000000005 111.247 177.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.53 -91.84 0.04 OUTLIER Glycine 0 CA--C 1.532 1.11 0 CA-C-N 116.226 -0.443 . . . . 45.149999999999999 113.56 179.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 17.7 m-80 -95.91 -15.04 22.66 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 122.548 -0.383 . . . . 74.329999999999998 111.609 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.411 ' OD2' ' HD3' ' A' ' 6' ' ' ARG . 4.6 m-20 -97.83 149.41 22.39 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 112.766 0.654 . . . . 74.5 112.766 -173.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.441 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 38.0 tp -138.82 100.7 4.12 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.451 -0.795 . . . . 45.200000000000003 110.671 175.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.509 ' HB3' ' HB ' ' A' ' 36' ' ' THR . 38.2 tt0 -89.78 104.37 16.94 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.56 -0.291 . . . . 75.230000000000004 111.387 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -101.75 108.72 24.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 CA-C-O 120.964 0.412 . . . . 60.420000000000002 111.08 177.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.581 ' HG2' ' HB3' ' A' ' 4' ' ' ASP . 94.1 mtt180 -97.82 108.91 21.72 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.743 0.306 . . . . 71.430000000000007 111.384 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 53.6 mt -94.48 121.94 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 120.76 0.314 . . . . 60.329999999999998 110.803 177.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 32.3 m -119.06 127.97 53.91 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.859 0.318 . . . . 60.200000000000003 111.859 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.91 61.79 1.26 Allowed Glycine 0 CA--C 1.527 0.837 0 C-N-CA 121.141 -0.552 . . . . 60.009999999999998 113.929 175.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 20.5 m -132.81 146.52 61.69 Favored Pre-proline 0 CA--C 1.542 0.669 0 O-C-N 122.504 -0.409 . . . . 60.149999999999999 111.554 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -71.73 137.59 30.23 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 122.514 2.143 . . . . 71.340000000000003 112.446 176.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' HG3' ' CZ ' ' A' ' 54' ' ' ARG . 36.4 tt0 -55.69 -36.73 67.47 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.879 0.696 . . . . 65.209999999999994 112.879 -175.6 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -59.06 -30.58 68.17 Favored 'General case' 0 CA--C 1.543 0.703 0 CA-C-O 121.041 0.448 . . . . 75.549999999999997 111.529 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.458 HG12 ' HG ' ' A' ' 57' ' ' LEU . 59.7 t -92.66 -32.33 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.515 -0.312 . . . . 73.549999999999997 111.281 178.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.554 ' HD2' HG21 ' A' ' 76' ' ' ILE . 46.4 ttp180 -47.22 -39.5 14.26 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-O 121.257 0.551 . . . . 72.420000000000002 111.338 177.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -52.9 -49.06 66.68 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.55 -0.75 . . . . 62.149999999999999 111.432 178.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -76.11 -34.87 59.48 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.114 -0.494 . . . . 72.340000000000003 111.556 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.458 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.9 mt -61.23 -33.33 73.32 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.027 0.441 . . . . 72.540000000000006 111.198 176.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.54 -39.08 88.4 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.017 0.437 . . . . 63.240000000000002 110.845 174.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.2 ttmm -70.95 -29.55 65.59 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.35 -0.386 . . . . 72.530000000000001 111.638 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.408 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 7.1 mm-40 -54.77 -38.21 66.95 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 120.911 0.386 . . . . 71.209999999999994 110.523 174.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.546 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -58.22 -44.04 87.98 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.129 -0.487 . . . . 75.349999999999994 111.053 174.205 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -64.05 -41.46 97.38 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.244 -0.435 . . . . 75.530000000000001 111.146 178.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 56.5 ttp85 -63.21 -44.29 95.73 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 116.202 -0.454 . . . . 71.310000000000002 110.867 178.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.525 HD22 ' HA ' ' A' ' 18' ' ' ALA . 96.2 mt -63.05 -37.18 86.18 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.084 -0.507 . . . . 62.539999999999999 111.606 178.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.18 -49.19 77.89 Favored 'General case' 0 CA--C 1.535 0.387 0 CA-C-O 121.197 0.522 . . . . 70.299999999999997 110.703 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -69.84 -25.93 63.97 Favored 'General case' 0 CA--C 1.541 0.608 0 CA-C-N 116.039 -0.528 . . . . 63.310000000000002 111.687 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.12 -53.1 62.08 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-O 121.125 0.488 . . . . 61.439999999999998 111.367 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -110.52 16.64 21.41 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 112.05 0.389 . . . . 73.239999999999995 112.05 177.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 22.7 m-80 60.6 23.8 13.55 Favored 'General case' 0 N--CA 1.476 0.83 0 CA-C-O 120.896 0.379 . . . . 74.040000000000006 111.917 177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.549 HD13 ' HB1' ' A' ' 14' ' ' ALA . 31.2 pt -91.13 179.22 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.219 0.533 . . . . 61.399999999999999 111.933 -176.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 88.5 m -101.33 149.86 23.6 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.208 -0.451 . . . . 71.310000000000002 111.223 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.546 HG21 ' HB1' ' A' ' 61' ' ' ALA . 11.2 p -144.92 133.85 17.86 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 121.423 0.63 . . . . 65.329999999999998 112.615 178.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.0 p -133.07 128.56 36.48 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 115.766 -0.652 . . . . 65.049999999999997 110.137 173.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 53.2 p90 -128.22 153.17 47.22 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.645 0.609 . . . . 72.329999999999998 112.645 -175.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.3 m -127.49 132.69 49.94 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 115.846 -0.616 . . . . 44.43 110.737 175.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.554 HG21 ' HD2' ' A' ' 54' ' ' ARG . 39.5 mt -121.48 110.12 26.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-O 121.167 0.508 . . . . 72.150000000000006 111.564 -179.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 12.3 ptm85 -93.93 144.46 25.43 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 115.921 -0.581 . . . . 74.319999999999993 111.35 -178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.484 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.3 pt? -142.83 167.29 22.42 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.149 -0.478 . . . . 71.129999999999995 111.034 -179.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -86.47 135.17 33.57 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 109.51 -0.552 . . . . 71.319999999999993 109.51 176.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -66.85 83.53 0.11 Allowed 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.426 0.631 . . . . 73.120000000000005 112.268 -176.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 31.2 m170 -86.73 160.12 18.93 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.238 -0.437 . . . . 61.450000000000003 110.558 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 20.1 p80 -161.39 142.56 11.36 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 111.88 0.326 . . . . 74.400000000000006 111.88 -173.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -137.17 127.84 27.01 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 120.742 0.306 . . . . 72.310000000000002 111.398 176.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 67.2 m-70 -92.73 159.61 15.34 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.068 0.461 . . . . 73.310000000000002 111.423 177.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 41.6 m170 . . . . . 0 C--O 1.251 1.135 0 CA-C-O 118.824 -0.607 . . . . 72.209999999999994 110.56 170.688 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.48 ' HE1' ' HD3' ' A' ' 54' ' ' ARG . 41.0 ttp . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.944 0.402 . . . . 44.219999999999999 111.27 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.416 ' N ' ' HG2' ' A' ' 1' ' ' MET . 29.9 mt-10 -100.04 147.0 26.09 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 116.196 -0.456 . . . . 54.439999999999998 110.293 173.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.469 ' HA ' HG12 ' A' ' 76' ' ' ILE . 21.7 ttt -148.36 108.25 4.03 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-O 121.11 0.481 . . . . 62.310000000000002 112.076 177.025 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.502 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 8.3 m-20 -92.97 110.15 21.61 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.116 -0.493 . . . . 73.439999999999998 110.627 174.034 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -115.6 116.88 53.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 CA-C-N 116.739 -0.209 . . . . 72.519999999999996 110.78 179.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.438 ' O ' ' HA ' ' A' ' 72' ' ' VAL . 1.8 ptp85 -105.76 128.51 53.75 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 112.338 0.496 . . . . 60.119999999999997 112.338 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -105.06 126.04 51.64 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 115.756 -0.656 . . . . 74.340000000000003 109.665 172.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -117.03 121.95 42.81 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.755 0.312 . . . . 73.239999999999995 111.238 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 177.52 157.97 19.58 Favored Glycine 0 CA--C 1.528 0.874 0 CA-C-N 116.043 -0.526 . . . . 65.329999999999998 112.346 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -93.46 -10.45 34.98 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 112.572 0.582 . . . . 70.140000000000001 112.572 -177.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -66.35 109.29 2.64 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.163 0.506 . . . . 71.319999999999993 111.369 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.2 tp -49.19 -55.51 12.24 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 113.31 0.855 . . . . 62.240000000000002 113.31 -174.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -62.73 -27.3 69.17 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.311 0.486 . . . . 65.209999999999994 112.311 -174.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.43 -37.65 67.95 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 120.928 0.394 . . . . 74.219999999999999 111.046 179.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.455 ' CD1' HD22 ' A' ' 42' ' ' LEU . 64.5 t80 -53.6 -52.05 61.07 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 115.896 -0.593 . . . . 61.5 111.0 174.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -69.38 -54.21 15.6 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 115.761 -0.654 . . . . 70.409999999999997 111.983 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -55.91 -46.74 78.33 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 112.374 0.509 . . . . 63.130000000000003 112.374 -174.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.57 -54.7 11.04 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 111.887 0.329 . . . . 71.430000000000007 111.887 179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 64.6 tp -55.91 -39.27 71.38 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.848 0.356 . . . . 70.140000000000001 111.508 -179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -63.09 -39.61 95.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.56 -0.291 . . . . 75.310000000000002 111.506 -178.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -68.81 -41.56 78.45 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 120.725 0.298 . . . . 64.409999999999997 111.313 177.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 87.7 mmm -59.99 -47.61 85.13 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 121.001 0.429 . . . . 73.129999999999995 110.949 177.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 71.0 mt -64.48 -44.64 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.594 0 CA-C-N 116.203 -0.453 . . . . 63.329999999999998 110.978 175.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 76.7 ttt180 -49.62 -50.7 41.9 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.261 0.624 . . . . 74.129999999999995 111.964 178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.554 ' HA ' ' HE3' ' A' ' 28' ' ' LYS . 2.8 mp0 -70.96 -41.21 71.39 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.31 -0.405 . . . . 75.430000000000007 111.739 178.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.71 -33.62 74.34 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 112.34 0.496 . . . . 33.520000000000003 112.34 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -61.37 -28.86 69.54 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.03 0.382 . . . . 62.109999999999999 112.03 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.554 ' HE3' ' HA ' ' A' ' 25' ' ' GLN . 10.4 mtmp? -70.22 -13.94 62.4 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.063 0.458 . . . . 75.129999999999995 111.147 175.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 84.8 m-85 -120.28 -172.25 2.32 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.095 -0.502 . . . . 73.049999999999997 110.559 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -94.51 36.2 1.17 Allowed 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 121.172 0.51 . . . . 72.030000000000001 110.888 174.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -83.12 122.71 5.84 Favored Glycine 0 CA--C 1.53 0.973 0 CA-C-N 116.232 -0.44 . . . . 73.430000000000007 113.867 -175.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.1 m -87.71 118.0 26.92 Favored 'General case' 0 N--CA 1.469 0.515 0 O-C-N 122.571 -0.37 . . . . 73.439999999999998 110.632 175.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 47.2 t -105.1 137.57 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-O 121.247 0.546 . . . . 72.430000000000007 112.291 -175.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.1 t -152.17 167.67 27.79 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.75 -0.659 . . . . 70.140000000000001 110.297 173.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.0 p90 -156.16 158.18 37.21 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.361 0.601 . . . . 75.129999999999995 112.345 -175.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.6 t -132.71 133.64 43.76 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.844 -0.616 . . . . 64.540000000000006 110.846 177.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -97.23 138.39 34.8 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.057 0.456 . . . . 73.349999999999994 111.814 -178.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -143.44 89.6 2.09 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 121.223 0.535 . . . . 70.219999999999999 110.555 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.74 -99.34 0.47 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 116.13 -0.486 . . . . 42.210000000000001 112.503 -175.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -114.14 12.8 17.92 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 120.883 0.373 . . . . 73.409999999999997 111.243 176.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -104.26 130.24 52.06 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.815 0.341 . . . . 55.119999999999997 111.26 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.455 HD22 ' CD1' ' A' ' 15' ' ' PHE . 47.8 tp -120.67 96.35 5.09 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.321 -0.4 . . . . 71.140000000000001 111.279 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -87.64 109.11 19.43 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 120.808 0.337 . . . . 70.439999999999998 110.832 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.7 mt -101.74 115.21 43.11 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-O 120.83 0.348 . . . . 72.329999999999998 111.925 -176.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HD2' ' OG1' ' A' ' 47' ' ' THR . 0.8 OUTLIER -95.45 121.26 36.94 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-O 121.189 0.519 . . . . 65.439999999999998 111.146 175.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.476 ' N ' ' HD3' ' A' ' 45' ' ' ARG . 47.1 mt -121.18 113.59 40.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.701 173.251 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.536 ' OG1' ' HD2' ' A' ' 45' ' ' ARG . 63.7 m -105.39 133.69 49.73 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.732 0.301 . . . . 55.219999999999999 111.365 -179.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 115.84 -10.69 18.37 Favored Glycine 0 CA--C 1.525 0.689 0 C-N-CA 120.899 -0.667 . . . . 63.219999999999999 113.747 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.461 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 22.5 m -63.49 133.9 95.67 Favored Pre-proline 0 CA--C 1.544 0.74 0 CA-C-N 116.926 0.363 . . . . 74.430000000000007 111.689 179.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 14.3 Cg_exo -69.34 147.64 66.04 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 122.757 2.305 . . . . 73.319999999999993 113.616 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -46.68 -52.7 13.24 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.814 -0.63 . . . . 64.439999999999998 112.46 178.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -58.94 -29.88 67.45 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.487 0.551 . . . . 74.129999999999995 112.487 -177.065 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.541 HG12 ' HG ' ' A' ' 57' ' ' LEU . 42.6 t -79.29 -16.13 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.776 0 CA-C-O 120.789 0.328 . . . . 52.439999999999998 111.652 -176.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB2' ' A' ' 58' ' ' ALA . 46.0 tpt85 -46.63 -37.87 8.82 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.104 0.562 . . . . 75.349999999999994 111.917 175.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt -65.91 -54.86 21.04 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.472 -0.785 . . . . 74.5 111.94 -177.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -64.28 -37.18 86.59 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 111.959 0.355 . . . . 54.520000000000003 111.959 -178.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.541 ' HG ' HG12 ' A' ' 53' ' ' VAL . 95.9 mt -60.34 -45.09 94.69 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.865 0.364 . . . . 61.420000000000002 111.458 178.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.631 ' HB2' ' NH1' ' A' ' 54' ' ' ARG . . . -63.78 -45.65 88.75 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.103 0.478 . . . . 63.240000000000002 111.462 178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -64.29 -31.76 73.09 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.035 -0.53 . . . . 54.450000000000003 111.316 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -72.69 -48.53 38.16 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 116.309 -0.405 . . . . 53.439999999999998 111.017 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.73 -42.32 71.43 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 112.22 0.452 . . . . 72.150000000000006 112.22 -179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -57.23 -48.7 78.14 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-O 120.734 0.302 . . . . 72.140000000000001 111.47 176.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.7 tmm_? -63.13 -37.07 85.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.272 -0.422 . . . . 73.400000000000006 110.823 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 96.6 mt -63.66 -43.6 96.25 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.99 0.424 . . . . 65.230000000000004 111.612 176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -70.21 -54.06 14.43 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 112.18 0.437 . . . . 70.010000000000005 112.18 -178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -62.47 -30.7 71.44 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 112.033 0.382 . . . . 73.099999999999994 112.033 -178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 tp10 -53.56 -39.5 64.82 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.837 0.351 . . . . 71.209999999999994 111.229 175.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -112.24 12.65 20.37 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 111.855 0.317 . . . . 73.219999999999999 111.855 179.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 61.3 t30 59.75 23.86 12.77 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-O 121.241 0.543 . . . . 55.520000000000003 111.898 177.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 32.1 pt -93.5 170.16 1.27 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.625 0 O-C-N 121.829 -0.544 . . . . 75.340000000000003 111.45 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 62.7 m -94.84 148.26 22.49 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 116.531 -0.304 . . . . 75.329999999999998 111.713 -178.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 13.6 p -146.72 133.25 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.777 0 CA-C-O 120.996 0.427 . . . . 33.140000000000001 111.997 178.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 61.6 p -132.67 167.6 19.79 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 122.161 -0.337 . . . . 51.25 110.988 175.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -125.35 146.23 49.67 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.948 0.404 . . . . 52.219999999999999 111.908 -174.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 99.0 m -140.22 122.82 16.25 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.269 -0.423 . . . . 65.140000000000001 110.654 174.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.469 HG12 ' HA ' ' A' ' 3' ' ' MET . 66.0 mt -134.2 132.12 55.49 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 N-CA-C 112.031 0.382 . . . . 51.049999999999997 112.031 -179.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 70.3 mtm180 -83.57 94.51 8.08 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 109.839 -0.43 . . . . 75.129999999999995 109.839 172.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -109.75 117.7 34.58 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.046 0.45 . . . . 72.0 111.422 -171.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -93.67 130.03 39.76 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.183 -0.462 . . . . 72.400000000000006 110.739 175.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 10.4 p80 -134.33 134.22 41.56 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.063 0.459 . . . . 64.209999999999994 111.334 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -73.44 138.02 44.92 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 116.149 -0.478 . . . . 71.340000000000003 111.593 -176.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 59.6 m80 -69.98 86.12 0.53 Allowed 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.554 0.693 . . . . 61.149999999999999 110.403 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 12.9 p-80 -75.12 77.77 2.27 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.276 -0.875 . . . . 72.030000000000001 112.724 -172.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -171.0 24.36 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 115.56 -0.745 . . . . 73.129999999999995 110.538 173.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 45.4 m80 . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.592 -0.718 . . . . 72.329999999999998 111.661 -179.835 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.9 mmm . . . . . 0 N--CA 1.489 1.476 0 CA-C-O 120.946 0.403 . . . . 72.319999999999993 110.711 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.54 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 2.3 tm-20 -137.49 130.99 31.19 Favored 'General case' 0 CA--C 1.546 0.799 0 N-CA-C 109.926 -0.398 . . . . 64.450000000000003 109.926 -175.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.546 ' SD ' HG13 ' A' ' 76' ' ' ILE . 12.8 tpt -115.89 120.3 38.77 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.955 1.095 . . . . 74.409999999999997 113.955 -161.388 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -97.87 120.67 38.67 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 116.471 -0.331 . . . . 64.430000000000007 110.777 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.414 HG13 ' HG3' ' A' ' 3' ' ' MET . 62.7 mt -127.07 140.04 50.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 CA-C-O 120.822 0.344 . . . . 64.439999999999998 111.028 177.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.42 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 67.0 mtt85 -137.89 121.7 17.6 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 121.951 -0.468 . . . . 74.099999999999994 112.001 -178.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.417 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 75.8 m-85 -100.33 144.9 28.79 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.94 0.4 . . . . 64.420000000000002 111.61 178.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.433 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 43.7 ttm180 -143.06 131.48 22.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.388 -0.369 . . . . 65.420000000000002 110.613 174.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 168.53 -145.94 9.98 Favored Glycine 0 CA--C 1.524 0.612 0 C-N-CA 119.845 -1.169 . . . . 73.209999999999994 114.355 177.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 11' ' ' ASP . 28.3 t70 -139.36 174.14 10.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 122.528 0.331 . . . . 72.200000000000003 111.138 -175.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.434 ' HB3' ' O ' ' A' ' 10' ' ' ASP . 26.8 t70 84.89 137.11 0.05 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.171 0.988 . . . . 74.129999999999995 112.103 178.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 55.8 tp -68.8 -49.07 61.63 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 116.013 -0.54 . . . . 73.319999999999993 111.743 -178.179 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.57 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 44.8 mt-10 -59.95 -34.35 73.14 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.609 0.242 . . . . 72.530000000000001 111.227 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.75 -44.4 69.93 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 120.933 0.397 . . . . 72.200000000000003 110.734 176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 31.0 t80 -65.78 -60.28 3.04 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 111.912 177.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 9.3 pt-20 -65.36 -41.86 93.4 Favored 'General case' 0 CA--C 1.541 0.596 0 N-CA-C 112.647 0.61 . . . . 75.409999999999997 112.647 -172.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -71.69 -46.58 58.31 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 122.219 -0.301 . . . . 73.430000000000007 111.6 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.477 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -61.17 -48.93 79.28 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.86 0.362 . . . . 73.450000000000003 111.027 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.436 ' O ' HG13 ' A' ' 23' ' ' ILE . 59.6 tp -58.33 -44.14 88.53 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.436 -0.347 . . . . 64.450000000000003 110.908 176.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -57.05 -47.75 80.19 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.476 -0.329 . . . . 71.120000000000005 111.68 179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 25' ' ' GLN . 21.9 mm-40 -58.94 -38.7 79.61 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.821 0.343 . . . . 54.43 111.592 176.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.477 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 86.9 mmm -67.64 -37.94 83.13 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 120.675 0.274 . . . . 74.019999999999996 111.036 176.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 19' ' ' LEU . 76.4 mt -64.7 -40.16 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-O 121.1 0.476 . . . . 65.420000000000002 110.569 174.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 22.5 ttt180 -57.57 -41.7 81.61 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-O 121.204 0.526 . . . . 74.099999999999994 110.663 176.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 21' ' ' GLU . 68.2 mt-30 -66.06 -45.16 82.31 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.149 -0.478 . . . . 73.540000000000006 110.636 173.68 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.44 ' HB2' HG21 ' A' ' 33' ' ' VAL . . . -55.97 -34.42 65.71 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.763 -0.653 . . . . 65.049999999999997 112.701 -178.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.415 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 10.3 mmm180 -63.13 -29.21 70.62 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-O 120.834 0.349 . . . . 71.25 111.422 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 26.4 mmmt -79.81 -18.33 51.18 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 112.058 0.392 . . . . 55.229999999999997 112.058 178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 21.2 m-85 -94.38 125.42 39.01 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 120.964 0.411 . . . . 52.530000000000001 111.704 -178.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.06 59.17 2.63 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-O 121.181 0.515 . . . . 43.149999999999999 111.223 177.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -150.78 -136.88 2.59 Favored Glycine 0 CA--C 1.527 0.806 0 CA-C-N 115.99 -0.55 . . . . 62.25 113.05 -178.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 69.1 m -142.68 139.21 31.08 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 111.919 0.34 . . . . 73.099999999999994 111.919 -175.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.555 HG22 HG23 ' A' ' 46' ' ' ILE . 98.3 t -121.65 137.1 56.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 CA-C-O 121.013 0.435 . . . . 70.340000000000003 111.608 178.272 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 47.3 p -117.58 150.84 38.32 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.052 -0.522 . . . . 63.100000000000001 111.003 -179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.651 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 39.9 p90 -155.88 131.95 9.99 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.203 0.525 . . . . 64.129999999999995 112.383 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.6 t -137.29 139.62 41.03 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.16 -0.473 . . . . 72.230000000000004 111.465 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -94.1 140.67 29.45 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 120.904 0.383 . . . . 64.230000000000004 111.788 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -141.81 86.95 2.02 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 121.157 0.503 . . . . 73.239999999999995 110.6 175.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.98 -94.93 0.15 Allowed Glycine 0 CA--C 1.524 0.649 0 CA-C-N 116.19 -0.459 . . . . 65.540000000000006 112.972 -178.153 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -107.68 -7.34 16.45 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.754 0.312 . . . . 74.109999999999999 111.116 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -93.71 150.92 20.01 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 121.244 0.545 . . . . 71.409999999999997 111.812 -178.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.435 ' HG ' HG13 ' A' ' 44' ' ' ILE . 29.8 tp -138.39 102.21 4.57 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.846 -0.616 . . . . 71.25 110.898 177.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.651 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 36.3 mm-40 -78.18 111.23 13.9 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.027 -0.533 . . . . 63.509999999999998 111.026 178.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.435 HG13 ' HG ' ' A' ' 42' ' ' LEU . 62.8 mt -122.03 109.79 25.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.053 0.454 . . . . 74.420000000000002 111.24 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -112.71 127.16 56.05 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.993 0.425 . . . . 65.030000000000001 110.995 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.555 HG23 HG22 ' A' ' 33' ' ' VAL . 54.7 mt -111.34 109.77 29.73 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 CA-C-O 121.092 0.473 . . . . 74.530000000000001 111.047 -179.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.54 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 89.4 m -98.68 109.26 22.04 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 116.083 -0.508 . . . . 72.549999999999997 111.546 -177.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 109.69 67.23 0.57 Allowed Glycine 0 CA--C 1.528 0.866 0 C-N-CA 121.404 -0.427 . . . . 71.120000000000005 113.312 179.323 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 14.5 m -122.13 143.2 38.44 Favored Pre-proline 0 N--CA 1.471 0.609 0 N-CA-C 112.069 0.396 . . . . 72.310000000000002 112.069 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.35 146.25 44.78 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 122.752 2.302 . . . . 74.140000000000001 112.597 176.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -54.89 -46.92 74.85 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.916 0.389 . . . . 61.130000000000003 111.967 -179.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.07 -22.06 60.16 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 112.463 0.542 . . . . 74.510000000000005 112.463 -177.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.47 HG12 ' HG ' ' A' ' 57' ' ' LEU . 48.6 t -85.92 -6.45 10.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-O 121.085 0.469 . . . . 60.210000000000001 111.488 -178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.439 ' HD3' HD12 ' A' ' 76' ' ' ILE . 47.6 tpt85 -50.28 -44.42 53.83 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 111.984 0.365 . . . . 64.439999999999998 111.984 176.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 25.8 pttm -63.5 -40.72 97.82 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 116.494 -0.321 . . . . 72.430000000000007 111.326 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.24 -51.89 61.39 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 116.358 -0.383 . . . . 73.129999999999995 111.169 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.47 ' HG ' HG12 ' A' ' 53' ' ' VAL . 93.3 mt -53.16 -49.37 66.78 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.876 0.37 . . . . 74.299999999999997 111.811 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -67.75 -51.12 52.83 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 120.999 0.428 . . . . 44.039999999999999 111.822 -179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -58.43 -42.63 87.71 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 115.955 -0.566 . . . . 72.420000000000002 112.257 -179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.633 ' HG3' HH21 ' A' ' 63' ' ' ARG . 0.4 OUTLIER -70.43 -43.29 70.25 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.235 -0.439 . . . . 73.439999999999998 111.783 178.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.52 -47.88 82.69 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.042 0.449 . . . . 74.420000000000002 111.314 176.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.425 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 45.1 mt-10 -61.66 -43.64 98.47 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 116.265 -0.425 . . . . 65.230000000000004 111.112 176.227 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.633 HH21 ' HG3' ' A' ' 60' ' ' GLU . 0.4 OUTLIER -55.97 -44.16 78.25 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 120.883 0.373 . . . . 72.230000000000004 111.227 176.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 96.2 mt -60.32 -48.87 79.87 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 121.0 0.429 . . . . 73.329999999999998 111.09 176.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.59 -52.33 65.87 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.151 -0.477 . . . . 72.099999999999994 112.023 -179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.488 ' HB3' ' NZ ' ' A' ' 66' ' ' LYS . 7.7 mtpm? -61.63 -44.67 96.55 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 112.033 -177.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -60.0 -34.2 73.01 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 120.83 0.348 . . . . 51.310000000000002 111.898 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -104.1 7.76 36.37 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.259 0.466 . . . . 73.409999999999997 112.259 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 58.68 30.98 20.65 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 112.468 0.544 . . . . 74.019999999999996 112.468 177.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 33.6 pt -109.6 177.13 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.009 0.433 . . . . 64.530000000000001 111.728 -179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.433 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 55.4 p -102.62 153.4 20.14 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-O 121.119 0.485 . . . . 72.019999999999996 111.921 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.5 p -152.11 141.56 15.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.128 0.489 . . . . 74.349999999999994 111.628 178.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 74.4 p -118.55 141.21 48.8 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.253 -0.43 . . . . 54.43 110.079 173.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.409 ' HB2' ' HE3' ' A' ' 3' ' ' MET . 21.6 p90 -140.86 120.06 12.93 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.55 -0.296 . . . . 71.430000000000007 111.002 -176.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 74.0 m -153.58 116.71 4.56 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.446 0.535 . . . . 72.340000000000003 112.446 -177.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 ' SD ' ' A' ' 3' ' ' MET . 29.1 mt -76.96 141.76 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-N 116.491 -0.322 . . . . 71.420000000000002 110.408 171.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.03 94.26 0.32 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.066 0.936 . . . . 65.430000000000007 110.999 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 84.6 mt -62.98 146.94 52.02 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 115.453 -0.794 . . . . 73.420000000000002 112.239 -176.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -95.29 137.12 34.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.106 -0.497 . . . . 75.329999999999998 110.956 177.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 51.1 m-70 -83.35 116.58 22.53 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 120.735 0.303 . . . . 70.420000000000002 110.384 179.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -68.33 -61.3 1.9 Allowed 'General case' 0 CA--C 1.54 0.587 0 CA-C-O 120.546 0.213 . . . . 73.430000000000007 111.272 -176.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 82.7 t60 68.64 -22.11 0.14 Allowed 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 114.299 1.222 . . . . 75.510000000000005 114.299 168.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 32.0 m170 -64.09 124.6 22.05 Favored 'General case' 0 N--CA 1.472 0.674 0 O-C-N 121.858 -0.526 . . . . 71.400000000000006 111.571 -177.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 84.3 t60 -104.48 142.29 34.88 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-O 121.258 0.551 . . . . 64.439999999999998 112.08 -177.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 70.5 m80 . . . . . 0 C--O 1.248 1.002 0 CA-C-O 118.828 -0.606 . . . . 74.140000000000001 111.015 174.712 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 44.7 ttp . . . . . 0 N--CA 1.49 1.526 0 CA-C-O 120.475 0.178 . . . . 74.530000000000001 110.553 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -124.38 164.08 20.41 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.971 0.415 . . . . 52.049999999999997 111.373 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.6 ttt -148.43 118.84 7.36 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 120.789 0.328 . . . . 61.149999999999999 111.828 -176.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.422 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 37.0 m-20 -94.81 104.77 16.68 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.779 0.324 . . . . 65.310000000000002 111.487 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.1 mt -105.12 146.45 12.21 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 122.33 0.252 . . . . 73.420000000000002 110.518 179.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.497 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 5.9 ptm180 -144.16 118.25 9.47 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-O 121.509 0.671 . . . . 75.239999999999995 111.882 175.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -90.41 149.88 22.08 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 115.774 -0.648 . . . . 64.319999999999993 110.331 174.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 0.8 OUTLIER -141.74 120.38 12.55 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.701 0.286 . . . . 72.329999999999998 110.431 -178.941 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.12 -164.83 36.21 Favored Glycine 0 CA--C 1.526 0.739 0 C-N-CA 121.065 -0.588 . . . . 53.130000000000003 113.143 -177.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -118.37 -24.48 6.85 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.21 0.448 . . . . 73.150000000000006 112.21 -176.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -60.9 118.32 6.55 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.516 0.562 . . . . 71.340000000000003 112.516 -173.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 58.2 tp -67.59 -43.59 80.17 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 116.067 -0.515 . . . . 71.519999999999996 111.741 -178.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 3.5 mp0 -53.97 -30.63 47.78 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.0 0.371 . . . . 62.420000000000002 112.0 -179.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -55.22 -40.36 70.75 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.488 -0.324 . . . . 61.100000000000001 111.713 179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.474 ' O ' ' HB3' ' A' ' 19' ' ' LEU . 84.3 t80 -53.42 -57.23 11.37 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.306 -0.406 . . . . 71.420000000000002 111.429 178.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -65.38 -57.22 8.88 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-O 120.83 0.348 . . . . 74.239999999999995 111.625 -178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 72.8 mmtt -59.77 -47.34 86.07 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 112.383 0.512 . . . . 74.329999999999998 112.383 -170.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.429 ' HB1' HD13 ' A' ' 64' ' ' LEU . . . -75.0 -58.71 3.12 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.547 0.573 . . . . 62.119999999999997 112.547 -179.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.474 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 67.7 tp -61.86 -53.29 57.9 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.194 0.442 . . . . 73.019999999999996 112.194 -173.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.1 tptp -60.56 -33.27 72.45 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 121.15 0.5 . . . . 74.140000000000001 110.755 -177.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.503 ' O ' ' HB3' ' A' ' 24' ' ' ARG . 16.1 tp10 -66.78 -44.2 81.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 123.33 0.652 . . . . 64.120000000000005 111.029 176.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 89.1 mtp -64.53 -44.61 90.31 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 120.994 0.425 . . . . 71.239999999999995 111.315 177.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.554 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.0 mt -61.15 -39.7 83.32 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 CA-C-O 120.905 0.383 . . . . 75.549999999999997 110.782 175.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' HB3' ' O ' ' A' ' 21' ' ' GLU . 52.3 ttt180 -49.38 -53.84 20.4 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 115.933 -0.576 . . . . 64.140000000000001 111.421 176.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.495 ' HA ' ' HE2' ' A' ' 28' ' ' LYS . 2.8 mp0 -61.04 -42.64 98.86 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 120.856 0.36 . . . . 64.340000000000003 111.273 175.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.37 -25.33 64.17 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.059 0.392 . . . . 74.439999999999998 112.059 177.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.554 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 3.9 mmp_? -77.96 -30.01 50.12 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 120.733 0.301 . . . . 74.430000000000007 111.529 176.006 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.495 ' HE2' ' HA ' ' A' ' 25' ' ' GLN . 54.1 mtmt -75.21 -35.84 61.45 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.015 0.436 . . . . 73.329999999999998 110.863 175.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 95.8 m-85 -90.4 -173.38 3.77 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 116.291 -0.413 . . . . 73.400000000000006 110.851 174.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -97.38 10.73 38.86 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 122.058 -0.401 . . . . 65.030000000000001 111.848 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -84.33 170.36 46.7 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 121.129 -0.558 . . . . 74.510000000000005 113.457 -177.398 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 85.7 m -134.22 136.22 43.53 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 122.428 -0.454 . . . . 74.319999999999993 111.3 178.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.459 HG22 HG12 ' A' ' 46' ' ' ILE . 95.4 t -109.92 123.92 66.22 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 121.0 0.429 . . . . 73.230000000000004 111.973 -178.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 t -117.15 158.93 23.4 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.442 -0.345 . . . . 54.329999999999998 110.664 173.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 34.4 p90 -155.07 143.8 20.67 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.928 0.394 . . . . 54.539999999999999 112.035 -174.214 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.0 t -126.6 129.94 49.53 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 121.001 0.429 . . . . 65.409999999999997 111.419 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.439 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.0 mm? -89.68 133.62 34.56 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 111.069 177.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.464 ' HB3' ' HB2' ' A' ' 41' ' ' ASP . 12.1 t70 -138.3 81.02 1.83 Allowed 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.349 -0.387 . . . . 72.400000000000006 110.488 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.51 -85.79 0.03 OUTLIER Glycine 0 CA--C 1.532 1.103 0 C-N-CA 121.428 -0.415 . . . . 72.140000000000001 113.634 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 p30 -117.0 9.43 13.68 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 120.989 0.423 . . . . 71.239999999999995 111.504 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.464 ' HB2' ' HB3' ' A' ' 38' ' ' ASP . 5.8 m-20 -112.66 128.75 56.47 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 116.295 -0.411 . . . . 74.310000000000002 111.553 179.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 tp -117.46 95.61 5.04 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.112 0.482 . . . . 75.299999999999997 110.331 174.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.497 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 32.4 mt-10 -93.5 112.15 23.98 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.261 0.553 . . . . 74.010000000000005 111.576 -176.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 64.9 mt -109.38 111.73 37.4 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.719 0 CA-C-N 115.752 -0.658 . . . . 72.510000000000005 111.988 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.491 HH12 ' HD2' ' A' ' 77' ' ' ARG . 51.4 ttt85 -101.85 128.18 48.34 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.903 0.383 . . . . 74.349999999999994 111.315 178.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.459 HG12 HG22 ' A' ' 33' ' ' VAL . 49.3 mt -111.29 130.73 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 CA-C-O 121.128 0.489 . . . . 74.25 111.586 179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 34.7 m -121.08 141.01 51.19 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-N 116.246 -0.434 . . . . 63.039999999999999 111.533 179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 87.23 46.16 5.09 Favored Glycine 0 CA--C 1.525 0.681 0 C-N-CA 121.247 -0.501 . . . . 51.140000000000001 113.59 177.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.8 m -125.31 139.23 33.34 Favored Pre-proline 0 CA--C 1.54 0.576 0 O-C-N 122.539 -0.389 . . . . 70.549999999999997 111.539 178.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -81.42 168.86 16.13 Favored 'Trans proline' 0 CA--C 1.542 0.881 0 C-N-CA 122.807 2.338 . . . . 73.349999999999994 113.033 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -55.52 -48.63 74.36 Favored 'General case' 0 CA--C 1.544 0.727 0 N-CA-C 112.57 0.581 . . . . 71.299999999999997 112.57 -178.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.435 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.8 pt20 -59.72 -42.45 93.14 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.386 0.513 . . . . 71.25 112.386 -176.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 52' ' ' GLN . 90.0 t -76.97 -30.91 18.34 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 CA-C-O 120.686 0.279 . . . . 74.349999999999994 111.496 -177.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -55.85 -46.0 78.3 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-O 120.663 0.268 . . . . 75.319999999999993 110.576 178.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 53.8 mtpt -57.16 -43.25 82.37 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-O 121.018 0.437 . . . . 71.209999999999994 111.304 176.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -64.02 -40.55 96.59 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 121.076 0.465 . . . . 74.219999999999999 111.293 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.0 mt -63.91 -41.73 97.6 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 116.402 -0.363 . . . . 62.020000000000003 111.171 176.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.96 -46.29 88.41 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.123 0.487 . . . . 71.420000000000002 111.217 176.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -55.61 -38.2 69.14 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.707 -0.679 . . . . 64.219999999999999 111.029 177.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.506 ' O ' ' HG ' ' A' ' 64' ' ' LEU . 8.9 tp10 -70.35 -52.22 24.24 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.02 -0.536 . . . . 71.329999999999998 110.841 176.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.487 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -52.35 -51.44 58.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 112.765 0.654 . . . . 72.439999999999998 112.765 -176.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 53.8 mt-10 -57.47 -37.09 72.34 Favored 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 120.958 0.408 . . . . 75.430000000000007 111.416 -179.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -72.12 -39.28 68.98 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 116.344 -0.389 . . . . 62.130000000000003 111.394 176.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 60' ' ' GLU . 94.4 mt -56.84 -45.51 82.32 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 120.999 0.428 . . . . 52.520000000000003 111.184 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.434 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -64.2 -50.71 67.02 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 116.148 -0.478 . . . . 54.509999999999998 111.478 177.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.55 ' HB3' ' NZ ' ' A' ' 66' ' ' LYS . 3.3 mmmp? -52.14 -44.3 64.46 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.119 -0.492 . . . . 74.239999999999995 112.193 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.15 -24.41 67.15 Favored 'General case' 0 CA--C 1.543 0.696 0 N-CA-C 112.123 0.416 . . . . 75.209999999999994 112.123 -176.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -114.86 10.75 16.5 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-O 120.761 0.315 . . . . 55.240000000000002 111.757 176.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.2 m120 62.03 16.06 7.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 112.992 0.738 . . . . 64.530000000000001 112.992 177.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.434 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 30.4 pt -92.27 165.71 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 CA-C-O 121.107 0.48 . . . . 73.099999999999994 111.953 -177.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.4 m -89.57 148.4 23.39 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-N 116.342 -0.39 . . . . 75.439999999999998 111.338 -179.176 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -149.26 134.49 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 121.099 0.476 . . . . 52.43 111.745 178.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.2 p -131.6 155.75 46.98 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 116.164 -0.471 . . . . 71.409999999999997 110.066 173.197 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.422 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 14.9 p90 -146.07 128.87 16.29 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.45 0.643 . . . . 62.140000000000001 112.624 -179.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 57.3 m -100.55 136.13 40.91 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.732 -0.667 . . . . 64.049999999999997 110.615 176.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 42.2 mm -102.21 135.62 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-O 120.644 0.259 . . . . 72.049999999999997 111.307 -179.441 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.491 ' HD2' HH12 ' A' ' 45' ' ' ARG . 7.9 ptp180 -139.71 134.25 31.67 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.304 0.573 . . . . 72.439999999999998 111.555 175.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.814 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.3 pt? -104.4 166.14 10.6 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.822 -0.626 . . . . 75.340000000000003 110.482 178.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.74 118.26 9.34 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.121 0.486 . . . . 65.439999999999998 110.346 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -71.46 90.87 1.0 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.44 0.638 . . . . 75.209999999999994 111.98 -177.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -114.93 117.54 30.93 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.999 -0.546 . . . . 64.140000000000001 111.226 -178.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 12.5 m-70 61.17 -96.64 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.916 0.487 . . . . 55.420000000000002 112.177 -176.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 86.0 t60 49.51 95.89 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 112.659 0.614 . . . . 55.009999999999998 112.659 -177.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -136.08 150.48 49.15 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.273 0.558 . . . . 72.340000000000003 112.151 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 85.0 t60 . . . . . 0 C--O 1.255 1.345 0 CA-C-N 115.498 -0.773 . . . . 70.310000000000002 111.188 176.482 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 30.6 ttp . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.905 0.383 . . . . 73.120000000000005 111.427 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.458 ' HG2' ' HA ' ' A' ' 47' ' ' THR . 35.7 mt-10 -84.86 169.55 14.01 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.646 0.26 . . . . 64.25 110.747 174.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.506 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 23.9 ttt -127.41 107.23 9.79 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 120.693 0.282 . . . . 65.140000000000001 111.585 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.567 ' HB2' ' HB ' ' A' ' 75' ' ' THR . 5.1 m-20 -93.38 128.28 39.36 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 116.078 -0.51 . . . . 60.32 111.268 178.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 52.6 mt -136.57 146.29 28.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.755 0 C-N-CA 122.403 0.281 . . . . 50.009999999999998 111.054 179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.442 ' HB2' ' OG1' ' A' ' 73' ' ' THR . 98.3 mtt180 -131.69 110.4 10.87 Favored 'General case' 0 N--CA 1.473 0.708 0 O-C-N 122.081 -0.387 . . . . 75.010000000000005 111.676 174.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -89.75 131.93 35.46 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.085 -0.507 . . . . 75.530000000000001 110.999 176.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -135.34 129.13 32.97 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 122.351 -0.218 . . . . 75.109999999999999 110.552 -179.296 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.85 -158.22 9.56 Favored Glycine 0 CA--C 1.527 0.839 0 C-N-CA 120.462 -0.875 . . . . 43.43 114.394 -176.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -113.28 13.94 19.21 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 112.761 0.652 . . . . 53.100000000000001 112.761 -175.465 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -143.9 150.28 38.17 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.24 0.543 . . . . 64.109999999999999 112.395 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 61.0 tp -77.02 -57.83 3.62 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.583 -0.735 . . . . 74.019999999999996 111.579 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 33.1 mt-10 -62.9 -27.14 69.16 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 112.122 0.416 . . . . 71.129999999999995 112.122 -176.351 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.58 -43.7 68.74 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.874 0.369 . . . . 64.329999999999998 110.942 174.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.433 ' HB3' HD22 ' A' ' 42' ' ' LEU . 25.1 m-85 -64.02 -41.55 97.41 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.115 0.483 . . . . 72.230000000000004 110.821 175.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -67.69 -33.16 74.35 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.81 -0.632 . . . . 42.009999999999998 111.497 -177.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.585 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 11.0 mmpt? -64.37 -52.77 56.62 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.214 0.53 . . . . 75.120000000000005 110.246 176.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.49 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -58.8 -46.73 86.92 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.832 -0.622 . . . . 73.329999999999998 111.188 177.472 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 62.4 tp -55.52 -47.21 76.61 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 115.844 -0.616 . . . . 64.230000000000004 111.436 176.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.9 tptm -60.53 -43.85 96.71 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.233 -0.439 . . . . 63.32 111.488 -177.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -63.56 -42.74 98.34 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 116.438 -0.346 . . . . 73.430000000000007 111.659 176.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.439 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 94.8 mmm -62.32 -44.37 96.66 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.673 -0.239 . . . . 75.299999999999997 111.364 177.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.428 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 74.8 mt -64.53 -45.84 94.41 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.562 0 CA-C-O 120.784 0.326 . . . . 74.209999999999994 111.089 176.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.9 ttp85 -54.29 -43.97 71.53 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 121.111 0.481 . . . . 53.439999999999998 111.332 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -74.07 -39.84 63.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.163 -0.472 . . . . 74.430000000000007 111.739 175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.46 ' HA ' ' HD2' ' A' ' 29' ' ' PHE . . . -59.76 -29.69 68.34 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.342 0.497 . . . . 60.539999999999999 112.342 -177.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.428 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.8 mtp180 -56.81 -28.38 61.4 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.11 0.411 . . . . 64.420000000000002 112.11 178.467 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -66.2 -26.98 67.64 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 111.958 0.355 . . . . 75.120000000000005 111.958 179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.46 ' HD2' ' HA ' ' A' ' 26' ' ' ALA . 44.9 m-85 -92.77 142.91 26.82 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.068 0.461 . . . . 75.040000000000006 111.646 -176.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -79.67 77.5 6.28 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.159 0.504 . . . . 41.240000000000002 110.941 176.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -154.47 -155.99 7.5 Favored Glycine 0 CA--C 1.529 0.913 0 C-N-CA 120.886 -0.673 . . . . 41.32 113.934 -177.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 37.8 m -128.57 139.72 52.15 Favored 'General case' 0 N--CA 1.475 0.81 0 O-C-N 122.648 -0.325 . . . . 71.420000000000002 111.408 -176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 41.5 t -114.61 130.29 69.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 120.794 0.331 . . . . 75.319999999999993 111.303 179.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.3 t -145.29 154.24 42.14 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 120.798 0.332 . . . . 61.409999999999997 111.679 178.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 p90 -156.38 161.79 40.1 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 121.108 0.48 . . . . 74.510000000000005 112.162 -179.568 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 6.7 t -137.36 141.89 41.79 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 116.117 -0.492 . . . . 52.420000000000002 110.765 174.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.9 tp -121.39 128.33 52.1 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.949 0.404 . . . . 75.230000000000004 111.832 -176.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -127.63 84.67 2.27 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.144 0.497 . . . . 64.120000000000005 110.386 173.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.04 -101.0 0.38 Allowed Glycine 0 CA--C 1.528 0.868 0 CA-C-N 115.66 -0.7 . . . . 64.019999999999996 114.258 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.4 m-20 -94.89 11.46 31.64 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 112.786 0.662 . . . . 73.239999999999995 112.786 -171.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -145.04 133.38 21.75 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 120.968 0.413 . . . . 72.329999999999998 111.522 -178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.433 HD22 ' HB3' ' A' ' 15' ' ' PHE . 65.5 tp -122.35 117.39 25.95 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 122.696 0.399 . . . . 74.450000000000003 111.902 -176.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -94.6 118.6 31.95 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-O 120.863 0.363 . . . . 71.409999999999997 111.253 176.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 46.5 mt -118.59 126.68 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 122.735 0.414 . . . . 75.439999999999998 110.761 179.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 3' ' ' MET . 39.9 ttp180 -125.15 121.09 33.19 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.952 0.405 . . . . 74.510000000000005 111.566 177.162 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 70.7 mt -100.43 119.56 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 CA-C-O 121.114 0.483 . . . . 73.510000000000005 110.843 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.458 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 59.2 m -92.35 112.49 24.46 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.946 -0.57 . . . . 74.010000000000005 111.913 -176.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 100.5 68.96 0.86 Allowed Glycine 0 CA--C 1.526 0.731 0 C-N-CA 121.241 -0.504 . . . . 62.210000000000001 113.571 177.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 11.2 m -126.3 130.32 23.96 Favored Pre-proline 0 CA--C 1.543 0.703 0 CA-C-O 120.799 0.333 . . . . 51.420000000000002 111.477 178.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 95.3 Cg_endo -77.49 155.41 31.96 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 C-N-CA 123.041 2.494 . . . . 74.010000000000005 114.153 -176.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -66.67 -41.68 87.77 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.823 -0.626 . . . . 71.25 112.437 -177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.485 ' HG3' HG23 ' A' ' 53' ' ' VAL . 11.4 pt20 -59.23 -26.63 65.04 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 112.132 0.419 . . . . 70.129999999999995 112.132 -178.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.485 HG23 ' HG3' ' A' ' 52' ' ' GLN . 38.3 t -98.4 -5.38 9.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 CA-C-O 120.992 0.425 . . . . 70.310000000000002 111.642 -179.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.506 ' NH1' ' SD ' ' A' ' 3' ' ' MET . 18.1 tpp180 -53.07 -40.7 64.23 Favored 'General case' 0 N--CA 1.474 0.765 0 O-C-N 122.214 -0.303 . . . . 71.120000000000005 111.048 178.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -50.93 -50.78 57.03 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 121.179 0.514 . . . . 71.409999999999997 111.5 177.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -66.73 -54.26 24.7 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.657 -0.701 . . . . 64.209999999999994 111.486 -176.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.3 mt -56.97 -46.97 81.82 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.052 -0.522 . . . . 71.519999999999996 111.905 -178.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -66.02 -33.93 76.94 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-O 120.876 0.369 . . . . 65.230000000000004 111.606 -179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -76.19 -36.42 58.65 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-O 120.908 0.385 . . . . 72.120000000000005 111.323 -179.189 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 28.6 tp10 -63.65 -45.37 90.5 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.921 0.391 . . . . 73.430000000000007 111.294 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.503 ' HA ' HD12 ' A' ' 64' ' ' LEU . . . -60.38 -35.3 75.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 116.385 -0.37 . . . . 43.420000000000002 111.575 177.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.493 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 23.0 mm-40 -55.23 -49.29 72.38 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-O 120.845 0.355 . . . . 63.049999999999997 110.15 172.144 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.512 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 20.9 ttm-85 -56.06 -53.22 59.6 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 116.11 -0.495 . . . . 71.310000000000002 110.594 176.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' A' ' 61' ' ' ALA . 88.5 mt -48.8 -46.85 42.3 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-N 115.714 -0.675 . . . . 71.519999999999996 112.18 -178.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.18 88.82 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.31 -0.405 . . . . 73.510000000000005 111.781 178.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 32.2 mmtp -72.36 -35.12 68.42 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.506 0.558 . . . . 72.430000000000007 112.506 -175.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 13.6 mm-40 -54.27 -41.42 68.83 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.051 0.453 . . . . 74.209999999999994 111.353 178.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -103.37 1.43 32.66 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.335 -0.393 . . . . 71.099999999999994 111.498 178.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 19.1 m120 54.24 42.32 31.56 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.488 0.661 . . . . 54.109999999999999 111.591 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 35.3 pt -103.74 169.3 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.595 0 CA-C-N 115.589 -0.732 . . . . 72.049999999999997 111.308 177.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.6 m -87.71 148.97 24.52 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 120.64 0.257 . . . . 62.509999999999998 111.645 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.27 136.17 14.43 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 CA-C-O 121.105 0.479 . . . . 73.409999999999997 112.051 179.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.442 ' OG1' ' HB2' ' A' ' 6' ' ' ARG . 73.6 p -118.22 146.47 44.22 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 116.429 -0.351 . . . . 72.200000000000003 111.179 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 75.7 m-85 -122.93 137.65 54.89 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 121.117 0.484 . . . . 75.420000000000002 112.225 -177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 97.6 m -136.34 105.44 5.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 116.012 -0.54 . . . . 55.240000000000002 109.972 173.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.405 ' CD1' ' HG3' ' A' ' 3' ' ' MET . 42.7 mm -101.29 105.48 17.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 O-C-N 122.26 -0.275 . . . . 64.510000000000005 110.987 -178.386 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.418 ' HG3' ' O ' ' A' ' 77' ' ' ARG . 18.3 ptp180 -81.2 100.71 9.25 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.629 0.728 . . . . 65.230000000000004 111.249 -178.591 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.1 tt -92.78 126.66 37.97 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 116.036 -0.529 . . . . 72.430000000000007 109.763 179.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -66.23 104.36 1.17 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 121.101 0.477 . . . . 74.329999999999998 112.022 -176.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 45.9 t-80 -126.75 110.35 13.02 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 116.029 -0.532 . . . . 72.409999999999997 110.599 175.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -140.0 140.45 36.26 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 120.917 0.389 . . . . 71.219999999999999 111.614 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 10.5 t60 -69.59 -48.11 61.26 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.263 0.468 . . . . 74.239999999999995 112.263 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 34.9 t-80 64.34 105.49 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.019 0.438 . . . . 70.109999999999999 111.935 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -110.3 154.65 23.17 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 116.497 -0.32 . . . . 64.450000000000003 111.154 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 8.2 p80 . . . . . 0 C--O 1.254 1.294 0 CA-C-O 119.491 -0.29 . . . . 71.230000000000004 111.429 175.18 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.827 ' SD ' HD13 ' A' ' 78' ' ' LEU . 47.3 ttp . . . . . 0 N--CA 1.488 1.454 0 CA-C-O 120.658 0.266 . . . . 74.25 110.512 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -117.27 155.74 28.96 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 112.01 0.374 . . . . 72.409999999999997 112.01 -172.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.631 ' HB3' ' NH1' ' A' ' 54' ' ' ARG . 21.8 ptm -149.59 142.36 24.64 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 112.338 0.495 . . . . 75.040000000000006 112.338 179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -112.67 118.36 34.82 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 122.602 0.361 . . . . 72.129999999999995 111.518 176.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.1 mt -115.96 114.54 46.49 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 CA-C-O 120.612 0.244 . . . . 71.010000000000005 110.862 175.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.456 ' HD2' ' N ' ' A' ' 6' ' ' ARG . 3.5 mpt_? -109.02 121.59 45.46 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 120.938 0.399 . . . . 75.040000000000006 111.809 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.571 ' HB2' ' HB3' ' A' ' 42' ' ' LEU . 88.4 m-85 -94.34 150.18 20.53 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 116.258 -0.428 . . . . 73.540000000000006 110.922 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.5 ' HA ' ' O ' ' A' ' 40' ' ' ASN . 17.2 tpt180 -142.39 120.42 12.1 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 116.276 -0.42 . . . . 65.120000000000005 110.878 -178.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.544 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -178.59 -179.35 48.41 Favored Glycine 0 CA--C 1.525 0.703 0 C-N-CA 120.978 -0.63 . . . . 71.129999999999995 113.108 179.629 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -108.49 -17.47 13.97 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.517 0.562 . . . . 61.329999999999998 112.517 -178.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -73.38 110.18 7.47 Favored 'General case' 0 CA--C 1.542 0.672 0 CA-C-O 121.027 0.441 . . . . 71.010000000000005 110.898 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 50.6 tp -62.38 -41.73 98.86 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.232 0.456 . . . . 65.310000000000002 112.232 -175.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -66.37 -35.03 79.31 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.577 0.227 . . . . 61.100000000000001 111.51 -179.419 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.47 -42.6 70.86 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 116.464 -0.334 . . . . 73.230000000000004 111.691 179.284 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 73.2 m-85 -56.18 -51.77 66.82 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.651 -0.249 . . . . 74.329999999999998 111.403 177.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.26 -45.24 85.33 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 120.736 0.303 . . . . 71.450000000000003 111.439 179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -57.83 -38.77 76.19 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.805 0.336 . . . . 72.120000000000005 111.804 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.551 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -73.96 -53.14 10.75 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.407 0.623 . . . . 73.239999999999995 111.234 177.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.6 tp -60.07 -46.1 90.67 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-N 115.628 -0.715 . . . . 65.140000000000001 112.525 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -58.6 -40.0 81.99 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.776 0.43 . . . . 75.319999999999993 111.646 -174.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -73.58 -38.83 65.04 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.889 0.376 . . . . 75.030000000000001 111.198 179.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 97.1 mmm -58.27 -46.58 85.77 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.066 0.46 . . . . 74.25 110.452 174.174 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 69.0 mt -64.63 -39.36 85.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-N 116.048 -0.524 . . . . 65.329999999999998 111.004 175.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.411 HH11 ' HD3' ' A' ' 24' ' ' ARG . 8.9 tpt180 -53.62 -50.11 66.39 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.855 0.36 . . . . 74.150000000000006 111.044 177.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 -67.1 -48.78 67.12 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 116.397 -0.365 . . . . 61.210000000000001 111.13 177.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.84 -34.08 67.42 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 112.685 0.624 . . . . 71.129999999999995 112.685 -178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.1 mtt180 -59.21 -27.74 66.0 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.024 0.379 . . . . 75.409999999999997 112.024 178.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -76.62 -18.26 58.71 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.816 0.341 . . . . 62.149999999999999 111.875 178.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -108.33 143.79 36.74 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 121.079 0.466 . . . . 74.400000000000006 111.679 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -80.3 89.6 5.52 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.077 0.465 . . . . 71.319999999999993 111.759 178.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -155.97 -155.53 7.42 Favored Glycine 0 CA--C 1.528 0.873 0 C-N-CA 121.246 -0.502 . . . . 73.120000000000005 112.975 179.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 62.3 m -137.73 131.29 31.1 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 122.519 -0.401 . . . . 63.119999999999997 111.258 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.437 HG22 HG23 ' A' ' 46' ' ' ILE . 88.8 t -124.81 118.62 53.77 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 CA-C-O 120.844 0.355 . . . . 74.340000000000003 111.264 178.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.448 ' OG1' ' HB3' ' A' ' 45' ' ' ARG . 30.3 p -107.41 129.76 54.89 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.531 -0.304 . . . . 71.219999999999999 111.007 179.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 52.7 p90 -133.0 142.74 49.0 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.349 0.5 . . . . 64.120000000000005 112.349 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.405 ' OG1' ' HB2' ' A' ' 43' ' ' GLU . 64.8 p -133.21 137.99 46.35 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.124 -0.489 . . . . 73.129999999999995 111.456 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -112.24 134.46 53.76 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 116.252 -0.431 . . . . 74.209999999999994 110.935 177.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -149.95 95.93 2.37 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 120.955 0.407 . . . . 42.509999999999998 111.396 174.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 63.66 -82.26 0.05 OUTLIER Glycine 0 CA--C 1.528 0.847 0 C-N-CA 121.263 -0.494 . . . . 75.340000000000003 113.532 178.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' ARG . 13.0 m120 -122.47 -3.65 8.85 Favored 'General case' 0 N--CA 1.468 0.468 0 O-C-N 122.489 -0.419 . . . . 75.010000000000005 112.014 -178.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -101.95 134.99 44.29 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 120.992 0.425 . . . . 70.430000000000007 111.822 -177.399 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 22.9 tp -128.91 99.96 5.49 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.022 -0.536 . . . . 74.25 110.366 175.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.432 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 46.0 mt-10 -91.92 104.48 16.9 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.003 0.43 . . . . 75.409999999999997 111.326 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.6 mt -102.14 128.8 54.4 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 CA-C-N 116.223 -0.444 . . . . 65.349999999999994 110.409 175.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.448 ' HB3' ' OG1' ' A' ' 34' ' ' THR . 51.1 ttt180 -126.16 112.57 15.95 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 120.93 0.395 . . . . 72.140000000000001 110.475 178.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.437 HG23 HG22 ' A' ' 33' ' ' VAL . 52.7 mt -104.85 114.47 44.54 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-O 121.246 0.546 . . . . 73.200000000000003 111.531 -176.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 28.6 m -105.14 113.82 27.65 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.848 -0.615 . . . . 63.509999999999998 111.769 -178.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 132.3 -43.54 1.28 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 120.599 -0.81 . . . . 62.100000000000001 114.515 174.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.57 HG23 HH21 ' A' ' 54' ' ' ARG . 17.6 m -50.7 128.8 26.89 Favored Pre-proline 0 N--CA 1.478 0.969 0 N-CA-C 113.833 1.049 . . . . 65.25 113.833 -172.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_endo -85.42 -169.26 0.58 Allowed 'Trans proline' 0 CA--C 1.545 1.032 0 C-N-CA 123.772 2.981 . . . . 75.019999999999996 114.277 -177.059 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -48.45 -72.02 0.06 Allowed 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 113.582 0.956 . . . . 75.239999999999995 113.582 -176.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.472 ' HA ' ' HE3' ' A' ' 55' ' ' LYS . 24.2 pt20 -50.11 -34.41 21.95 Favored 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.754 0.65 . . . . 64.349999999999994 112.754 -174.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 t -80.23 -36.02 16.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 CA-C-O 120.989 0.423 . . . . 60.549999999999997 111.447 -179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.631 ' NH1' ' HB3' ' A' ' 3' ' ' MET . 4.5 tpp180 -53.77 -52.78 59.11 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.85 -0.614 . . . . 74.209999999999994 112.016 -177.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.472 ' HE3' ' HA ' ' A' ' 52' ' ' GLN . 22.2 pttp -61.67 -34.68 76.16 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.091 -0.504 . . . . 54.439999999999998 111.951 -179.372 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -71.53 -42.51 67.85 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.66 0.267 . . . . 74.150000000000006 111.617 -179.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.436 HD11 HG11 ' A' ' 49' ' ' VAL . 86.6 mt -64.45 -45.35 87.84 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 120.945 0.402 . . . . 73.519999999999996 111.183 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.29 96.59 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.171 0.51 . . . . 71.299999999999997 111.203 176.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 25.0 ttpp -63.77 -35.43 80.58 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 116.043 -0.526 . . . . 73.310000000000002 111.593 177.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -67.12 -42.56 84.3 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 120.915 0.388 . . . . 71.349999999999994 110.998 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.558 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -52.17 -40.84 62.02 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 116.082 -0.508 . . . . 65.400000000000006 112.058 178.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 35.0 mm-40 -61.74 -50.55 71.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.727 0.298 . . . . 72.150000000000006 111.682 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 37.3 ttm180 -55.45 -51.7 66.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.94 0.4 . . . . 74.049999999999997 111.101 176.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.551 HD22 ' HA ' ' A' ' 18' ' ' ALA . 83.4 mt -55.39 -41.28 72.45 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 115.745 -0.661 . . . . 32.109999999999999 111.465 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.533 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -64.68 -50.96 64.97 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 121.178 0.513 . . . . 34.5 112.256 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 10.5 mmpt? -63.19 -60.54 3.28 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 113.096 0.776 . . . . 61.340000000000003 113.096 -171.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -75.44 -15.77 60.4 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 112.962 0.727 . . . . 72.150000000000006 112.962 -172.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.44 ' HB2' ' O ' ' A' ' 64' ' ' LEU . 84.9 m-85 -100.6 8.57 43.34 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 122.079 -0.388 . . . . 72.310000000000002 111.973 177.275 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 60.46 35.75 20.28 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 112.584 0.587 . . . . 75.329999999999998 112.584 173.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.544 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.6 pt -126.06 149.38 30.88 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.655 0 CA-C-O 121.184 0.516 . . . . 64.329999999999998 111.639 179.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.7 m -86.97 139.59 30.44 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.403 -0.362 . . . . 62.229999999999997 110.735 178.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.558 HG21 ' HB1' ' A' ' 61' ' ' ALA . 14.5 p -126.22 122.1 60.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.547 0.689 . . . . 63.420000000000002 112.414 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 80.9 p -121.18 121.7 38.37 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.788 -0.642 . . . . 73.109999999999999 110.449 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -122.05 143.09 49.71 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 112.869 0.692 . . . . 75.439999999999998 112.869 -175.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 94.4 m -122.54 120.26 33.29 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.567 -0.742 . . . . 75.049999999999997 110.612 178.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 52.7 mt -118.79 144.86 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.959 0.409 . . . . 70.299999999999997 111.451 -178.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 77' ' ' ARG . 59.3 mmt-85 -123.68 110.47 15.01 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.023 0.44 . . . . 74.319999999999993 111.513 175.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.827 HD13 ' SD ' ' A' ' 1' ' ' MET . 33.3 tp -117.23 112.9 21.44 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.248 -0.433 . . . . 71.230000000000004 110.774 175.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -67.82 95.56 0.52 Allowed 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.232 0.539 . . . . 74.120000000000005 110.81 178.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 32.6 p-80 -118.2 128.42 54.69 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.076 -0.511 . . . . 70.329999999999998 111.3 -178.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -79.18 142.34 36.41 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 116.128 -0.487 . . . . 71.049999999999997 111.428 -177.465 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 60.4 m80 -63.74 113.14 3.19 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.956 0.408 . . . . 62.340000000000003 110.523 176.009 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 74.4 m-70 -67.5 -38.79 84.86 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 112.689 0.626 . . . . 74.409999999999997 112.689 -170.795 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -123.33 163.78 20.09 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.925 0.393 . . . . 72.140000000000001 111.822 -179.114 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 . . . . . 0 C--O 1.254 1.307 0 CA-C-O 118.79 -0.624 . . . . 72.519999999999996 111.733 176.944 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.643 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 49.4 ttp . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 121.044 0.45 . . . . 70.109999999999999 111.51 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.664 ' HB2' ' HB2' ' A' ' 77' ' ' ARG . 27.3 mt-10 -127.42 170.8 12.15 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.115 -0.493 . . . . 73.099999999999994 110.774 -179.564 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.658 ' SD ' ' NH2' ' A' ' 54' ' ' ARG . 27.5 ttt -143.69 128.0 17.78 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 112.649 0.611 . . . . 65.209999999999994 112.649 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.503 ' HB3' ' CZ ' ' A' ' 6' ' ' ARG . 4.7 m-20 -82.72 128.86 34.77 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.665 -0.698 . . . . 54.350000000000001 110.222 171.729 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 56.7 mt -139.56 109.42 3.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 CA-C-O 120.77 0.319 . . . . 74.549999999999997 111.146 178.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.696 ' HG3' ' HA ' ' A' ' 43' ' ' GLU . 2.4 mpt_? -119.45 125.41 48.87 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 122.104 -0.373 . . . . 65.129999999999995 111.975 -179.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -109.11 145.56 35.49 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 116.26 -0.427 . . . . 73.0 111.498 178.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.4 ttp85 -142.5 120.09 11.77 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.316 -0.253 . . . . 73.5 110.316 172.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -148.73 159.68 28.12 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 120.649 -0.786 . . . . 52.399999999999999 113.693 -176.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -90.98 -13.02 34.17 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.148 0.425 . . . . 73.530000000000001 112.148 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -80.27 161.08 25.3 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.039 0.447 . . . . 65.310000000000002 111.933 -177.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 68.3 tp -85.51 -58.51 2.64 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 120.948 0.404 . . . . 75.239999999999995 111.674 178.628 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 41.4 mt-10 -66.78 -30.25 70.41 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 111.979 0.363 . . . . 62.310000000000002 111.979 -175.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.2 -33.17 51.64 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 111.997 0.369 . . . . 64.010000000000005 111.997 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.425 ' CE1' HD11 ' A' ' 37' ' ' LEU . 77.4 t80 -59.68 -53.56 56.64 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.109 0.481 . . . . 72.430000000000007 111.213 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -73.78 -36.9 65.11 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.016 -0.538 . . . . 74.400000000000006 111.906 -176.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 75.2 mmtt -59.59 -54.21 49.12 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-O 120.948 0.404 . . . . 63.340000000000003 111.306 179.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.474 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.48 -47.76 84.74 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 116.255 -0.43 . . . . 70.439999999999998 111.724 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.5 tp -59.32 -45.44 91.32 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 121.026 0.441 . . . . 64.209999999999994 111.55 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 51.4 tptt -64.07 -42.91 96.83 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.303 -0.408 . . . . 62.329999999999998 111.653 -177.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -61.8 -46.51 89.23 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.103 0.408 . . . . 73.530000000000001 112.103 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.474 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 78.2 mmm -56.52 -44.8 81.14 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 120.845 0.355 . . . . 75.540000000000006 111.196 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.536 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 67.9 mt -66.13 -43.43 92.16 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-O 121.054 0.454 . . . . 71.530000000000001 110.936 175.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 46.4 ttt85 -53.02 -54.68 31.77 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 123.229 0.612 . . . . 73.329999999999998 112.017 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -67.07 -37.75 84.57 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 120.774 0.321 . . . . 73.010000000000005 111.512 176.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -60.24 -25.24 65.51 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 112.222 0.452 . . . . 71.409999999999997 112.222 179.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.536 ' HG2' ' O ' ' A' ' 23' ' ' ILE . 11.8 mmm180 -56.59 -27.79 58.8 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.142 0.423 . . . . 65.140000000000001 112.142 177.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.429 ' N ' ' HE3' ' A' ' 28' ' ' LYS . 0.8 OUTLIER -61.96 -25.56 67.68 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 111.788 0.292 . . . . 72.129999999999995 111.788 178.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.444 ' CZ ' HG21 ' A' ' 53' ' ' VAL . 23.4 m-85 -118.06 171.73 7.89 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 121.449 0.642 . . . . 72.299999999999997 112.074 -173.761 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -102.16 90.52 3.96 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 116.047 -0.524 . . . . 75.030000000000001 110.574 173.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -152.17 164.7 30.58 Favored Glycine 0 CA--C 1.523 0.579 0 C-N-CA 120.975 -0.631 . . . . 52.0 113.355 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 84.7 m -95.95 123.26 39.47 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.777 0.322 . . . . 73.530000000000001 111.594 -177.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 57.3 t -115.31 119.35 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 CA-C-N 116.255 -0.429 . . . . 71.400000000000006 110.552 175.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -130.87 164.48 25.14 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 120.701 0.286 . . . . 64.540000000000006 111.426 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.544 ' HB2' HD11 ' A' ' 42' ' ' LEU . 43.9 p90 -155.23 146.97 23.25 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-O 121.007 0.432 . . . . 73.549999999999997 111.683 -177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.557 HG23 ' HB3' ' A' ' 43' ' ' GLU . 0.7 OUTLIER -137.32 137.38 38.88 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.886 0.374 . . . . 74.140000000000001 111.406 178.395 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.425 HD11 ' CE1' ' A' ' 15' ' ' PHE . 4.0 mm? -87.4 130.47 34.64 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.914 0.388 . . . . 60.420000000000002 111.568 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -132.58 106.32 7.75 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 120.992 0.425 . . . . 75.150000000000006 110.878 178.427 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 64.47 -97.0 0.22 Allowed Glycine 0 CA--C 1.528 0.906 0 C-N-CA 121.229 -0.51 . . . . 54.329999999999998 113.335 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -125.29 11.14 8.08 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 112.132 0.419 . . . . 63.399999999999999 112.132 -179.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -132.67 158.96 40.99 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.353 0.597 . . . . 64.150000000000006 112.407 -179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD11 ' HB2' ' A' ' 35' ' ' TYR . 64.0 tp -109.08 125.29 51.97 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.778 -0.647 . . . . 74.140000000000001 111.604 -177.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.696 ' HA ' ' HG3' ' A' ' 6' ' ' ARG . 1.5 tm-20 -101.87 108.37 19.82 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.269 -0.423 . . . . 71.340000000000003 110.471 179.647 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.9 mt -108.6 139.78 29.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.08 0.466 . . . . 73.230000000000004 112.245 -177.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 72.7 ttt180 -125.28 123.28 39.13 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 116.072 -0.513 . . . . 74.439999999999998 110.763 176.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 58.8 mt -115.59 121.83 68.11 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-O 120.819 0.343 . . . . 73.439999999999998 111.45 177.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.531 HG23 ' HG2' ' A' ' 2' ' ' GLU . 86.2 m -121.86 126.74 49.41 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.28 -0.418 . . . . 74.200000000000003 111.601 -178.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 111.15 55.32 0.51 Allowed Glycine 0 CA--C 1.532 1.104 0 C-N-CA 121.238 -0.506 . . . . 52.020000000000003 113.941 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 24.7 m -133.58 144.37 51.82 Favored Pre-proline 0 N--CA 1.474 0.734 0 O-C-N 122.356 -0.497 . . . . 74.25 111.783 -179.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -85.83 162.83 10.53 Favored 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 122.909 2.406 . . . . 72.400000000000006 113.598 179.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -62.55 -37.06 84.64 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 112.361 0.504 . . . . 74.409999999999997 112.361 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -60.3 -18.53 50.07 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.736 0.643 . . . . 74.120000000000005 112.736 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.54 HG12 ' HG ' ' A' ' 57' ' ' LEU . 16.4 t -112.42 -2.68 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 CA-C-O 121.397 0.617 . . . . 62.329999999999998 111.066 177.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.658 ' NH2' ' SD ' ' A' ' 3' ' ' MET . 5.3 tpm_? -52.59 -58.38 6.97 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 115.87 -0.604 . . . . 65.540000000000006 112.525 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 52.9 mtpt -66.05 -33.34 75.58 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 116.036 -0.529 . . . . 74.150000000000006 111.625 -176.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -62.85 -50.56 70.47 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.21 -0.45 . . . . 72.430000000000007 111.235 178.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HG ' HG12 ' A' ' 53' ' ' VAL . 98.7 mt -61.36 -38.48 87.12 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 120.931 0.396 . . . . 61.530000000000001 111.206 177.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.12 -42.26 98.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 116.219 -0.446 . . . . 74.439999999999998 111.678 178.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 62' ' ' GLU . 22.0 ttmm -78.51 -32.73 48.26 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 120.903 0.383 . . . . 53.329999999999998 111.954 179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ARG . 29.1 tt0 -64.16 -32.87 74.61 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.952 -0.467 . . . . 72.109999999999999 110.555 176.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -57.4 -38.41 74.25 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 116.372 -0.377 . . . . 73.150000000000006 110.845 171.583 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 59' ' ' LYS . 43.5 mt-10 -59.64 -43.72 93.76 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.979 0.419 . . . . 72.129999999999995 110.574 175.009 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.541 ' O ' ' HB2' ' A' ' 67' ' ' GLU . 33.8 ttm180 -54.95 -54.0 48.38 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 116.28 -0.418 . . . . 71.140000000000001 111.347 177.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.435 HD22 ' HA ' ' A' ' 18' ' ' ALA . 93.5 mt -56.42 -39.19 72.65 Favored 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 120.98 0.419 . . . . 75.319999999999993 111.687 -178.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -72.14 -57.13 4.51 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-O 121.069 0.461 . . . . 73.230000000000004 111.938 179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -66.82 -24.86 66.22 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.403 0.52 . . . . 74.230000000000004 112.403 -174.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.541 ' HB2' ' O ' ' A' ' 63' ' ' ARG . 0.3 OUTLIER -61.18 -47.92 83.94 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.116 0.484 . . . . 72.450000000000003 110.587 179.211 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -104.27 8.68 36.11 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.152 -0.476 . . . . 62.210000000000001 111.396 178.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 60.96 24.92 14.96 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 112.494 0.553 . . . . 74.019999999999996 112.494 179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.2 pt -87.77 166.43 1.91 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-O 121.006 0.431 . . . . 75.510000000000005 111.673 -177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 37.2 m -87.54 142.5 27.8 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.48 -0.327 . . . . 72.299999999999997 111.366 -178.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.437 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 14.6 p -143.62 134.97 22.77 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 CA-C-O 121.135 0.493 . . . . 62.520000000000003 111.839 177.653 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -119.43 123.09 43.22 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 109.697 -0.483 . . . . 74.540000000000006 109.697 171.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.439 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 34.0 p90 -128.46 135.32 49.3 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.232 0.539 . . . . 65.510000000000005 111.829 -177.41 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.405 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 86.6 m -133.39 148.55 51.82 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.888 -0.596 . . . . 61.240000000000002 110.781 -178.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 27.9 mm -101.99 114.28 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 120.907 0.384 . . . . 74.120000000000005 111.196 179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.664 ' HB2' ' HB2' ' A' ' 2' ' ' GLU . 13.7 mtp180 -84.58 106.61 16.28 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 112.177 0.436 . . . . 74.109999999999999 112.177 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.404 HD22 ' N ' ' A' ' 78' ' ' LEU . 3.0 mm? -103.3 158.91 16.0 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.018 -0.537 . . . . 74.450000000000003 110.049 170.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -72.57 139.91 47.76 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.519 -0.31 . . . . 71.25 110.897 176.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 23.0 p80 -75.22 67.92 1.9 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 122.075 0.94 . . . . 54.200000000000003 109.112 172.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 38.5 t-80 -65.96 133.31 50.59 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 114.711 -1.131 . . . . 62.299999999999997 111.633 -171.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -72.24 102.23 3.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.038 -0.528 . . . . 73.219999999999999 110.515 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 77.4 t60 -152.29 139.26 19.07 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 116.209 -0.45 . . . . 74.409999999999997 111.551 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -124.89 177.71 5.88 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.115 -0.493 . . . . 73.010000000000005 110.35 177.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 22.8 p-80 . . . . . 0 C--O 1.248 1.026 0 O-C-N 122.361 -0.212 . . . . 75.319999999999993 111.407 177.352 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 tmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.806 -0.442 . . . . 73.129999999999995 109.806 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -102.58 148.72 25.2 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 120.926 0.394 . . . . 73.319999999999993 111.469 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.7 ttt -124.36 124.44 42.37 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.146 0.498 . . . . 61.109999999999999 112.123 -176.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -106.12 115.34 30.06 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.967 -0.56 . . . . 64.239999999999995 110.798 178.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 54.2 mt -120.72 141.69 40.03 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 122.42 0.288 . . . . 63.409999999999997 111.089 -178.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.473 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 26.4 mtm105 -144.37 122.63 12.26 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.153 0.427 . . . . 70.310000000000002 112.153 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.465 ' O ' ' HA ' ' A' ' 41' ' ' ASP . 95.8 m-85 -103.13 125.43 49.83 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-N 116.473 -0.33 . . . . 70.400000000000006 111.628 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.509 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 8.2 tpt180 -104.33 119.33 38.73 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 120.813 0.34 . . . . 75.239999999999995 110.616 175.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -171.43 146.63 9.64 Favored Glycine 0 CA--C 1.524 0.617 0 C-N-CA 121.235 -0.507 . . . . 74.430000000000007 113.029 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -94.28 3.07 55.73 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 122.461 -0.434 . . . . 62.219999999999999 112.111 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -78.08 134.27 37.75 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.089 0.471 . . . . 71.420000000000002 111.991 177.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 57.6 tp -71.3 -52.76 17.07 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.218 -0.446 . . . . 44.299999999999997 111.606 -179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.29 -31.2 67.26 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.783 0.325 . . . . 65.209999999999994 111.792 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.97 -40.14 69.73 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 116.518 -0.31 . . . . 73.439999999999998 111.69 179.824 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 55.6 t80 -56.64 -54.26 48.1 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 120.904 0.383 . . . . 64.439999999999998 111.333 176.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -64.02 -49.95 70.38 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 116.355 -0.384 . . . . 71.439999999999998 111.765 -178.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 70.3 mmtt -61.87 -54.57 40.29 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.331 0.493 . . . . 75.530000000000001 112.331 -178.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.494 ' HA ' HD22 ' A' ' 64' ' ' LEU . . . -57.71 -48.55 79.24 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.82 0.343 . . . . 64.510000000000005 111.879 -177.506 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 54.7 tp -63.72 -44.68 92.87 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-O 120.856 0.36 . . . . 64.120000000000005 111.333 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -62.49 -46.01 90.39 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 111.966 0.358 . . . . 71.120000000000005 111.966 -177.236 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 17' ' ' LYS . 25.7 mm-40 -64.82 -45.54 85.76 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-O 120.634 0.254 . . . . 75.140000000000001 111.557 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 1.6 mmt -55.8 -50.64 69.94 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 121.125 0.488 . . . . 72.530000000000001 111.017 176.671 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.559 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 64.9 mt -62.18 -42.47 95.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 CA-C-N 116.269 -0.423 . . . . 73.450000000000003 111.429 177.615 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 15.7 ttm-85 -49.28 -48.12 46.28 Favored 'General case' 0 N--CA 1.475 0.791 0 CA-C-O 121.108 0.48 . . . . 62.109999999999999 111.474 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -68.43 -46.08 70.84 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 115.939 -0.573 . . . . 75.420000000000002 111.829 -179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -69.37 -22.39 63.73 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.225 0.824 . . . . 52.32 113.225 -175.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.559 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 37.1 mtp85 -56.68 -28.66 61.21 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 112.777 0.658 . . . . 65.150000000000006 112.777 -179.135 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.427 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 0.4 OUTLIER -74.78 -20.95 59.58 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 111.969 0.359 . . . . 63.240000000000002 111.969 179.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -106.73 178.0 4.69 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-O 121.393 0.616 . . . . 62.130000000000003 112.181 -173.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -89.94 28.07 1.45 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.953 -0.567 . . . . 24.129999999999999 111.269 176.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -93.16 128.87 9.63 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 116.074 -0.512 . . . . 74.299999999999997 113.182 -178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 96.2 m -88.49 117.37 27.39 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.883 0.373 . . . . 73.430000000000007 111.026 178.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.495 HG22 HG12 ' A' ' 46' ' ' ILE . 77.1 t -103.41 109.79 28.02 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 CA-C-O 120.996 0.427 . . . . 72.420000000000002 111.225 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.4 t -110.86 157.06 20.26 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.361 -0.381 . . . . 71.319999999999993 110.894 176.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.431 ' HB2' HD11 ' A' ' 42' ' ' LEU . 29.3 p90 -140.96 133.87 29.09 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.128 0.489 . . . . 75.120000000000005 112.1 -176.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 31.9 p -129.61 130.54 45.78 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.078 -0.51 . . . . 72.420000000000002 110.528 176.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -91.36 120.35 32.15 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 111.946 0.35 . . . . 52.539999999999999 111.946 -176.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -113.25 88.97 2.96 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-O 120.941 0.4 . . . . 71.430000000000007 109.973 171.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 59.68 -101.2 0.23 Allowed Glycine 0 CA--C 1.529 0.917 0 C-N-CA 121.167 -0.54 . . . . 70.319999999999993 113.558 -178.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -109.03 13.21 24.76 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 122.584 -0.363 . . . . 62.210000000000001 111.669 -178.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.465 ' HA ' ' O ' ' A' ' 7' ' ' PHE . 21.8 t70 -119.47 121.85 40.38 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 121.134 0.492 . . . . 74.420000000000002 110.654 178.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.431 HD11 ' HB2' ' A' ' 35' ' ' TYR . 41.5 tp -94.47 106.84 18.83 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.194 -0.457 . . . . 73.209999999999994 110.897 178.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.473 ' HG2' ' HG2' ' A' ' 6' ' ' ARG . 36.2 mt-10 -85.06 103.85 14.44 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 120.97 0.414 . . . . 70.299999999999997 111.068 -178.593 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 68.3 mt -103.55 113.2 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 120.984 0.421 . . . . 75.239999999999995 111.066 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -109.06 120.82 43.67 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 120.813 0.339 . . . . 64.420000000000002 111.154 -178.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.495 HG12 HG22 ' A' ' 33' ' ' VAL . 53.4 mt -110.99 112.39 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 CA-C-O 120.942 0.401 . . . . 74.430000000000007 111.214 -178.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 73.0 m -107.01 132.49 52.88 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 112.186 0.439 . . . . 71.230000000000004 112.186 -177.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 82.86 62.02 1.88 Allowed Glycine 0 CA--C 1.529 0.945 0 C-N-CA 121.409 -0.424 . . . . 74.5 114.152 175.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 15.0 m -133.01 139.03 33.16 Favored Pre-proline 0 CA--C 1.545 0.773 0 O-C-N 122.481 -0.423 . . . . 52.409999999999997 111.944 177.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_endo -58.05 132.61 50.44 Favored 'Trans proline' 0 CA--C 1.541 0.842 0 C-N-CA 122.738 2.292 . . . . 74.329999999999998 113.081 179.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -52.11 -36.4 50.94 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 113.076 0.769 . . . . 53.119999999999997 113.076 -174.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -67.2 -34.76 78.19 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 120.803 0.335 . . . . 73.450000000000003 111.871 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.2 t -75.21 -19.19 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 121.105 0.478 . . . . 62.399999999999999 111.185 -179.469 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 53.9 ttp180 -50.6 -36.47 35.13 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 116.044 -0.526 . . . . 74.439999999999998 111.971 177.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -61.91 -43.08 99.58 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.702 -0.226 . . . . 73.329999999999998 111.496 177.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -64.61 -43.35 94.05 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 120.802 0.334 . . . . 72.340000000000003 111.121 177.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.3 mt -61.8 -42.61 99.23 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 121.02 0.438 . . . . 74.420000000000002 111.05 177.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.406 ' O ' ' HG3' ' A' ' 62' ' ' GLU . . . -67.87 -45.33 74.82 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 65.319999999999993 111.591 179.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -65.95 -32.82 74.53 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 120.845 0.355 . . . . 75.129999999999995 111.427 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.59 -45.46 93.88 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.641 -0.503 . . . . 74.129999999999995 109.641 172.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.32 -41.75 97.52 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.137 -0.483 . . . . 52.240000000000002 111.541 176.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 58' ' ' ALA . 47.2 mt-10 -55.54 -45.51 77.19 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.279 0.561 . . . . 74.010000000000005 110.533 175.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.407 ' HD3' HH11 ' A' ' 63' ' ' ARG . 9.8 tpt180 -64.98 -49.51 69.99 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 115.584 -0.735 . . . . 74.209999999999994 111.412 179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.494 HD22 ' HA ' ' A' ' 18' ' ' ALA . 91.8 mt -54.43 -45.2 72.97 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.029 0.381 . . . . 73.519999999999996 112.029 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.27 -56.72 15.73 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.807 0.337 . . . . 74.519999999999996 111.724 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -61.85 -35.75 79.19 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 112.147 0.425 . . . . 75.319999999999993 112.147 -177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -59.74 -34.94 73.61 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-O 121.03 0.443 . . . . 71.420000000000002 111.243 -178.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -105.71 0.04 25.9 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 116.349 -0.387 . . . . 72.310000000000002 111.553 175.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 46.5 m-80 61.17 21.62 12.04 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.113 0.565 . . . . 71.430000000000007 112.078 -177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.448 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 33.2 pt -86.92 175.34 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.015 0.436 . . . . 65.219999999999999 111.239 179.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 22.8 m -93.54 146.42 23.81 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-O 120.738 0.304 . . . . 73.109999999999999 111.318 -178.037 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 12.2 p -137.6 139.57 43.01 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.481 0 CA-C-O 121.148 0.499 . . . . 33.130000000000003 111.518 177.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.9 p -132.49 143.13 49.55 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.086 -0.507 . . . . 72.319999999999993 110.097 174.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -147.57 134.13 19.82 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 121.213 0.53 . . . . 74.120000000000005 111.916 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 72.3 p -121.08 145.0 48.25 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.957 -0.565 . . . . 71.340000000000003 110.822 178.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 40.7 mm -117.26 144.78 24.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.626 -0.261 . . . . 75.540000000000006 110.945 -177.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 19.6 ptt180 -143.39 141.36 30.86 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 121.234 0.54 . . . . 73.219999999999999 111.66 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 55.4 tp -104.67 120.45 41.36 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 115.974 -0.557 . . . . 71.450000000000003 110.061 175.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.59 94.03 0.08 Allowed 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 120.978 0.418 . . . . 72.319999999999993 111.393 -177.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 35.3 t60 -154.37 120.39 5.29 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.356 -0.384 . . . . 74.140000000000001 110.946 179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -79.55 99.64 7.39 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 121.097 0.475 . . . . 64.239999999999995 111.503 -178.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -68.98 92.01 0.5 Allowed 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 116.32 -0.4 . . . . 61.25 111.134 177.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -73.09 128.58 35.89 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 120.86 0.362 . . . . 72.319999999999993 111.318 178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -88.92 136.53 32.96 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 120.913 0.387 . . . . 73.519999999999996 111.866 -179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 39.8 p-80 . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.826 -0.607 . . . . 74.420000000000002 111.169 175.964 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.62 ' SD ' ' HA ' ' A' ' 51' ' ' GLU . 88.0 mtp . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.14 0.495 . . . . 74.530000000000001 111.558 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -133.43 147.4 51.71 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.005 -0.543 . . . . 72.140000000000001 109.586 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.457 ' SD ' ' NH1' ' A' ' 54' ' ' ARG . 28.6 ttt -148.88 118.99 7.19 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.092 0.775 . . . . 72.400000000000006 113.092 -173.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.402 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 6.5 m-20 -87.97 119.39 28.29 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 116.445 -0.343 . . . . 62.109999999999999 110.38 172.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 51.2 mt -116.33 108.4 25.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.032 0.444 . . . . 71.209999999999994 111.064 178.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.426 ' HG2' ' HB2' ' A' ' 43' ' ' GLU . 61.8 mtm-85 -98.56 102.1 13.74 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.575 0.583 . . . . 74.200000000000003 112.575 -176.225 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -85.78 143.24 28.42 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.454 -0.339 . . . . 73.230000000000004 110.305 172.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.569 ' O ' ' HB ' ' A' ' 70' ' ' ILE . 43.9 ttt180 -141.47 118.88 11.5 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.564 0.221 . . . . 73.329999999999998 110.599 179.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -153.96 153.19 24.65 Favored Glycine 0 CA--C 1.527 0.799 0 C-N-CA 121.194 -0.527 . . . . 63.109999999999999 113.136 -176.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -97.49 -14.27 21.22 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 113.045 0.757 . . . . 64.230000000000004 113.045 -174.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.444 ' CG ' ' H ' ' A' ' 12' ' ' LEU . 7.2 p-10 -72.66 -91.13 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 112.87 0.693 . . . . 75.310000000000002 112.87 -174.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.444 ' H ' ' CG ' ' A' ' 11' ' ' ASP . 57.9 tp 171.14 -51.82 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.145 0.578 . . . . 74.549999999999997 110.04 -176.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.552 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 48.7 mt-10 -62.39 -29.93 70.84 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.652 -0.704 . . . . 54.039999999999999 111.687 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.71 -39.67 62.27 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-O 120.817 0.342 . . . . 75.319999999999993 111.383 -179.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 54.5 t80 -62.47 -60.53 3.42 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 120.928 0.394 . . . . 61.409999999999997 111.574 176.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -63.12 -50.51 70.2 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.499 0.555 . . . . 71.329999999999998 112.499 -174.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.552 ' HG2' ' O ' ' A' ' 13' ' ' GLU . 65.0 mmtt -67.02 -46.1 75.49 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 111.742 0.275 . . . . 74.310000000000002 111.742 -174.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -63.96 -46.21 85.7 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.781 0.324 . . . . 74.120000000000005 111.369 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 59.0 tp -56.03 -47.23 78.23 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 121.017 0.437 . . . . 64.340000000000003 110.566 176.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -52.07 -55.92 17.66 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 115.704 -0.68 . . . . 74.129999999999995 112.166 176.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -63.89 -42.5 97.44 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.157 0.429 . . . . 73.209999999999994 112.157 -176.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.429 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 77.6 mmm -61.94 -45.16 94.91 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 120.636 0.255 . . . . 74.420000000000002 111.294 178.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.439 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 66.7 mt -60.36 -40.45 84.02 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.733 0.302 . . . . 75.299999999999997 110.634 175.283 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -56.6 -41.98 77.94 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 120.866 0.365 . . . . 73.420000000000002 111.041 175.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 25.5 mm-40 -69.28 -42.87 74.94 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 121.059 0.457 . . . . 72.450000000000003 111.183 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.82 -35.52 81.36 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 116.377 -0.374 . . . . 63.149999999999999 111.816 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.439 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 41.4 mtp85 -64.36 -28.88 70.0 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.189 0.44 . . . . 73.450000000000003 112.189 178.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -55.32 -43.39 74.87 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 121.285 0.564 . . . . 73.430000000000007 110.491 173.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 76.7 m-85 -97.84 -6.15 33.17 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.773 -0.649 . . . . 74.219999999999999 111.838 -179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 60.17 42.83 14.84 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.053 0.454 . . . . 42.340000000000003 111.922 179.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -87.57 -175.96 48.45 Favored Glycine 0 CA--C 1.531 1.084 0 C-N-CA 121.268 -0.491 . . . . 72.340000000000003 113.784 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 33.6 m -94.76 131.45 40.58 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.649 0.38 . . . . 74.310000000000002 111.315 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 59.5 t -124.34 125.56 70.62 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 N-CA-C 112.165 0.431 . . . . 62.310000000000002 112.165 -178.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 t -136.26 144.83 45.01 Favored 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 116.217 -0.447 . . . . 72.120000000000005 110.773 173.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.451 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 44.3 p90 -142.84 140.68 31.38 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 112.566 0.58 . . . . 73.109999999999999 112.566 -176.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 58.4 p -115.24 141.83 47.49 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 116.01 -0.541 . . . . 71.340000000000003 111.696 -179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -113.36 125.73 54.59 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 121.031 0.443 . . . . 74.430000000000007 112.067 179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -141.47 96.35 2.97 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.29 -0.414 . . . . 73.209999999999994 110.346 174.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.89 -101.12 0.62 Allowed Glycine 0 CA--C 1.531 1.048 0 C-N-CA 120.993 -0.622 . . . . 61.219999999999999 112.862 -176.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -110.04 3.93 20.81 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.973 0.416 . . . . 70.430000000000007 110.992 175.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -93.8 130.74 39.69 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.097 -0.502 . . . . 73.109999999999999 112.044 -175.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.1 tp -131.68 101.55 5.53 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.097 -0.502 . . . . 74.409999999999997 110.955 179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.451 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.5 tt0 -97.27 108.77 21.57 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.884 0.374 . . . . 75.010000000000005 111.116 177.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 44.8 mt -101.95 108.57 24.06 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-N 116.226 -0.443 . . . . 65.420000000000002 110.867 178.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -93.11 111.3 22.89 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.878 0.371 . . . . 61.420000000000002 110.684 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 51.7 mt -101.98 110.41 28.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-O 121.312 0.577 . . . . 65.239999999999995 110.734 178.164 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 16.1 m -97.84 130.44 44.75 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.986 -0.552 . . . . 72.239999999999995 111.154 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 116.05 -15.88 15.82 Favored Glycine 0 CA--C 1.528 0.899 0 C-N-CA 120.95 -0.643 . . . . 52.32 113.558 178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.928 HG23 HH22 ' A' ' 54' ' ' ARG . 15.1 m -61.2 138.64 94.5 Favored Pre-proline 0 CA--C 1.542 0.668 0 CA-C-N 117.221 0.511 . . . . 73.109999999999999 112.086 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.62 -176.87 3.2 Favored 'Trans proline' 0 CA--C 1.542 0.894 0 C-N-CA 123.191 2.594 . . . . 61.240000000000002 114.286 -173.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.62 ' HA ' ' SD ' ' A' ' 1' ' ' MET . 10.2 pt-20 -90.49 -50.48 5.92 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 112.581 0.585 . . . . 64.299999999999997 112.581 -176.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -64.11 -40.5 96.33 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.649 0.611 . . . . 70.439999999999998 112.649 -174.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.415 ' O ' HG12 ' A' ' 53' ' ' VAL . 22.8 t -73.58 -3.33 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.803 0 CA-C-O 120.955 0.407 . . . . 75.299999999999997 111.847 -177.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.928 HH22 HG23 ' A' ' 49' ' ' VAL . 18.4 tpp180 -51.22 -35.39 36.53 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 112.127 0.417 . . . . 72.319999999999993 112.127 -178.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -55.76 -53.59 54.82 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.255 0.55 . . . . 75.420000000000002 111.378 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -74.54 -32.86 62.6 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 116.158 -0.474 . . . . 70.420000000000002 111.864 -179.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.3 mt -56.75 -43.66 80.97 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-O 121.114 0.483 . . . . 53.329999999999998 111.065 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -69.67 -43.07 73.29 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.026 0.441 . . . . 74.109999999999999 111.109 175.052 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -56.52 -39.61 73.64 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.961 -0.563 . . . . 75.329999999999998 111.94 178.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -64.81 -48.22 75.19 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 120.908 0.385 . . . . 44.32 110.904 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.28 -43.9 88.21 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.155 -0.475 . . . . 61.25 111.264 177.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 66' ' ' LYS . 49.5 mt-10 -60.96 -42.14 97.72 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 116.309 -0.405 . . . . 71.439999999999998 111.168 176.741 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.581 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 27.9 ttm180 -55.26 -54.9 37.61 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.69 0.281 . . . . 75.439999999999998 110.653 174.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 94.5 mt -52.63 -45.9 66.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.17 -0.468 . . . . 71.420000000000002 111.675 -178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.29 -43.67 98.48 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 116.402 -0.363 . . . . 72.5 111.85 178.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 62' ' ' GLU . 34.0 mmtp -72.3 -30.23 64.6 Favored 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 112.178 0.436 . . . . 65.150000000000006 112.178 -177.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.581 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 16.7 mm-40 -61.9 -38.51 88.62 Favored 'General case' 0 N--CA 1.472 0.66 0 O-C-N 122.118 -0.364 . . . . 73.430000000000007 111.598 178.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 89.3 m-85 -100.87 -5.89 25.48 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 111.862 0.319 . . . . 62.530000000000001 111.862 178.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 56.64 60.03 3.28 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-O 121.643 0.735 . . . . 75.400000000000006 110.551 -173.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.569 ' HB ' ' O ' ' A' ' 8' ' ' ARG . 39.6 pt -125.39 -176.37 1.38 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-N 115.502 -0.772 . . . . 71.409999999999997 111.28 -178.644 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 8' ' ' ARG . 30.5 m -98.89 141.42 31.69 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.596 -0.275 . . . . 44.109999999999999 111.712 -177.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.1 p -142.03 129.26 20.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 CA-C-O 121.449 0.642 . . . . 74.409999999999997 111.792 176.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 64.5 p -129.87 123.29 30.47 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 116.12 -0.491 . . . . 43.229999999999997 110.273 175.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 6.7 p90 -125.57 136.63 53.5 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.523 0.677 . . . . 74.439999999999998 112.734 -175.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 64.9 m -103.56 123.16 46.43 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.512 -0.767 . . . . 62.32 110.936 179.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.669 HD12 ' HD2' ' A' ' 54' ' ' ARG . 42.4 mm -94.22 114.13 30.24 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 120.68 0.276 . . . . 75.230000000000004 111.67 -178.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 71.3 mtt180 -104.43 111.07 23.58 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-O 120.952 0.406 . . . . 74.099999999999994 111.317 177.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.8 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.2 pt? -92.17 136.55 33.09 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 110.06 -0.348 . . . . 74.519999999999996 110.06 173.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.04 120.26 12.3 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.077 0.465 . . . . 64.519999999999996 110.903 -176.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 71.2 m80 -71.1 120.33 16.51 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.683 0.623 . . . . 54.420000000000002 112.683 -171.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -135.92 127.2 28.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.905 -0.589 . . . . 65.430000000000007 109.884 173.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.522 ' HD2' ' HB3' ' A' ' 85' ' ' HIS . 68.5 t60 -70.42 95.93 1.1 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 112.709 0.633 . . . . 73.219999999999999 112.709 -171.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 50.3 m-70 -71.63 173.11 8.52 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 116.495 -0.32 . . . . 62.420000000000002 110.727 171.815 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 58.1 t-80 62.77 29.45 16.72 Favored 'General case' 0 CA--C 1.545 0.784 0 CA-C-O 121.009 0.433 . . . . 73.439999999999998 110.823 179.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . 0.522 ' HB3' ' HD2' ' A' ' 82' ' ' HIS . 17.1 p-80 . . . . . 0 C--O 1.252 1.23 0 CA-C-O 118.533 -0.746 . . . . 73.319999999999993 112.18 -178.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.528 ' SD ' ' N ' ' A' ' 2' ' ' GLU . 6.3 tmm? . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 110.062 -0.347 . . . . 55.109999999999999 110.062 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.528 ' N ' ' SD ' ' A' ' 1' ' ' MET . 26.5 mt-10 -132.62 137.71 47.13 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.072 0.463 . . . . 72.430000000000007 111.788 -175.556 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.539 ' HG3' HG12 ' A' ' 76' ' ' ILE . 26.3 ttt -139.33 106.91 5.58 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 115.943 -0.571 . . . . 72.420000000000002 111.247 -170.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.482 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 16.0 m-20 -90.89 106.93 18.86 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 122.476 0.311 . . . . 62.450000000000003 111.39 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.9 mm -97.51 109.3 23.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 CA-C-O 120.706 0.289 . . . . 75.340000000000003 111.208 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 2.5 ttp180 -118.67 116.35 26.41 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-O 121.325 0.583 . . . . 72.109999999999999 112.097 -179.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -95.15 142.57 27.43 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 115.839 -0.618 . . . . 74.510000000000005 111.379 179.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.2 tpt85 -141.91 121.11 13.01 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.144 -0.48 . . . . 73.340000000000003 111.222 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.61 -165.22 36.47 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 120.964 -0.636 . . . . 35.219999999999999 113.311 177.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -123.66 102.13 7.67 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 122.48 -0.424 . . . . 60.229999999999997 111.867 -179.274 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -176.82 141.86 0.38 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.051 -0.522 . . . . 75.340000000000003 110.416 175.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 33.1 tp -76.01 -44.48 39.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 111.97 0.359 . . . . 74.450000000000003 111.97 -175.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' A' ' 17' ' ' LYS . 4.8 mp0 -73.97 -27.52 61.03 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 112.1 0.407 . . . . 53.43 112.1 -179.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -52.99 -47.59 68.12 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 113.193 0.812 . . . . 31.120000000000001 113.193 -173.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 98.7 m-85 -60.95 -61.27 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 112.22 0.452 . . . . 65.439999999999998 112.22 -176.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -65.46 -39.38 91.93 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 112.597 0.591 . . . . 73.400000000000006 112.597 -178.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.505 ' HB2' ' O ' ' A' ' 13' ' ' GLU . 10.5 mmmt -65.83 -52.93 46.41 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 112.27 0.47 . . . . 62.310000000000002 112.27 -179.412 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.49 -40.8 88.19 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 121.294 0.568 . . . . 61.520000000000003 110.791 178.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.4 tp -63.26 -41.44 99.05 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 115.682 -0.69 . . . . 53.530000000000001 111.43 175.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -57.22 -48.46 78.74 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.157 -0.474 . . . . 65.530000000000001 111.935 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -60.61 -44.87 95.81 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 121.09 0.472 . . . . 74.319999999999993 111.384 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . . . . . . . . . 96.3 mmm -61.53 -49.08 78.15 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 116.192 -0.458 . . . . 72.420000000000002 111.525 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 58.8 mt -63.82 -37.68 80.36 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 CA-C-O 120.741 0.305 . . . . 73.349999999999994 111.366 178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 10.0 tpt180 -53.67 -47.9 69.96 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-O 120.892 0.377 . . . . 75.540000000000006 111.119 177.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.642 ' HA ' ' HD3' ' A' ' 28' ' ' LYS . 72.2 mm-40 -74.35 -40.16 62.33 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 116.322 -0.399 . . . . 64.239999999999995 111.276 178.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.13 -38.58 79.97 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.308 0.484 . . . . 50.329999999999998 112.308 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.2 mtp85 -59.92 -29.55 68.45 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.061 0.458 . . . . 72.349999999999994 111.466 176.575 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.642 ' HD3' ' HA ' ' A' ' 25' ' ' GLN . 50.7 mtpt -72.22 -13.81 61.62 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.162 -0.472 . . . . 73.329999999999998 111.759 178.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -110.46 -177.26 3.19 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 121.013 0.435 . . . . 70.319999999999993 111.167 177.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -96.93 -10.72 25.78 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 120.765 0.317 . . . . 54.43 111.746 178.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -66.34 150.61 51.95 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 121.488 -0.387 . . . . 74.109999999999999 113.76 179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -97.41 144.52 27.07 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.028 0.442 . . . . 63.140000000000001 111.518 -179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.444 HG22 HG23 ' A' ' 46' ' ' ILE . 84.5 t -129.36 131.61 67.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 CA-C-N 116.161 -0.472 . . . . 53.530000000000001 111.045 178.15 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -131.8 140.25 49.12 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 120.733 0.302 . . . . 45.100000000000001 110.92 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -131.8 151.48 51.64 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 112.291 0.478 . . . . 74.200000000000003 112.291 -174.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 t -137.26 131.68 32.67 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 116.062 -0.517 . . . . 65.549999999999997 111.33 179.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 HD13 ' A' ' 42' ' ' LEU . 4.0 mm? -100.91 123.61 45.36 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 120.947 0.403 . . . . 75.340000000000003 111.271 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -121.7 83.86 2.16 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.26 0.552 . . . . 71.319999999999993 110.209 174.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 61.23 -101.2 0.3 Allowed Glycine 0 CA--C 1.528 0.857 0 CA-C-N 115.752 -0.658 . . . . 62.409999999999997 113.159 -177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -108.58 21.77 16.84 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.059 0.457 . . . . 55.109999999999999 111.437 -179.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -127.94 140.5 51.96 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 116.087 -0.506 . . . . 73.109999999999999 110.377 179.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.438 ' O ' ' HA ' ' A' ' 6' ' ' ARG . 31.7 tp -134.17 118.81 18.07 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 112.104 0.409 . . . . 74.329999999999998 112.104 -177.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -108.83 131.77 54.66 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-O 120.641 0.257 . . . . 72.200000000000003 110.743 175.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 54.2 mt -127.11 109.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 CA-C-O 120.88 0.372 . . . . 71.5 110.981 -179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.431 HH11 ' HD2' ' A' ' 45' ' ' ARG . 15.2 ttp85 -92.48 108.54 20.04 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-O 121.002 0.429 . . . . 73.209999999999994 111.402 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.444 HG23 HG22 ' A' ' 33' ' ' VAL . 58.2 mt -102.74 136.63 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 CA-C-N 116.11 -0.496 . . . . 52.450000000000003 111.369 179.011 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.8 m -144.04 121.77 11.9 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 122.24 -0.288 . . . . 63.140000000000001 111.386 178.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 133.04 -27.8 3.41 Favored Glycine 0 CA--C 1.529 0.945 0 C-N-CA 120.87 -0.681 . . . . 62.450000000000003 114.275 176.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 30.3 m -71.24 134.64 84.91 Favored Pre-proline 0 CA--C 1.544 0.746 0 O-C-N 122.238 -0.566 . . . . 72.239999999999995 111.7 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -67.97 153.91 74.08 Favored 'Trans proline' 0 CA--C 1.543 0.968 0 C-N-CA 122.719 2.279 . . . . 64.209999999999994 113.512 -177.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.4 ' HG3' ' H ' ' A' ' 51' ' ' GLU . 0.0 OUTLIER -56.73 -31.24 64.34 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.555 0.946 . . . . 62.409999999999997 113.555 -175.527 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -71.83 -33.88 68.84 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 112.411 0.523 . . . . 72.010000000000005 112.411 179.534 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -81.41 -30.12 10.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 CA-C-O 121.186 0.517 . . . . 73.109999999999999 110.677 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.476 ' HE ' ' HB3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -49.09 -45.75 43.69 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.591 -0.731 . . . . 73.340000000000003 112.194 177.357 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -65.18 -31.03 72.0 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 120.865 0.364 . . . . 64.230000000000004 111.712 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -71.51 -44.67 64.24 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.091 0.472 . . . . 74.349999999999994 110.233 177.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 88.5 mt -63.34 -35.78 81.52 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 116.045 -0.525 . . . . 72.450000000000003 111.15 176.903 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.38 -45.05 95.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.996 0.427 . . . . 74.019999999999996 111.247 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -58.2 -43.71 87.76 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.168 -0.469 . . . . 73.230000000000004 110.85 177.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.65 -42.23 86.97 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.132 -0.486 . . . . 74.5 111.191 179.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -55.79 -45.42 78.22 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.993 0.425 . . . . 71.200000000000003 111.418 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -64.99 -36.47 84.51 Favored 'General case' 0 CA--C 1.54 0.566 0 CA-C-O 120.987 0.422 . . . . 72.239999999999995 111.034 176.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.421 ' O ' ' HG2' ' A' ' 67' ' ' GLU . 9.9 tpp180 -59.49 -48.04 83.18 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.249 -0.432 . . . . 63.509999999999998 110.26 175.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 87.6 mt -55.29 -43.6 74.94 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 115.695 -0.684 . . . . 75.019999999999996 111.627 178.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.97 -46.56 75.07 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 121.185 0.517 . . . . 64.219999999999999 111.278 176.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -66.32 -38.01 86.69 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.966 -0.561 . . . . 72.450000000000003 111.409 179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 63' ' ' ARG . 8.1 mm-40 -53.27 -35.4 60.01 Favored 'General case' 0 N--CA 1.473 0.686 0 CA-C-N 116.409 -0.36 . . . . 63.310000000000002 111.834 179.295 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -114.74 6.19 15.51 Favored 'General case' 0 CA--C 1.542 0.635 0 N-CA-C 112.315 0.487 . . . . 73.329999999999998 112.315 -179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.542 HD22 ' N ' ' A' ' 69' ' ' ASN . 0.8 OUTLIER 60.83 24.97 14.89 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-O 120.844 0.354 . . . . 74.150000000000006 111.834 179.499 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -101.49 -179.51 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 CA-C-O 120.902 0.382 . . . . 63.310000000000002 111.506 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 95.6 m -102.67 131.75 49.25 Favored 'General case' 0 N--CA 1.471 0.605 0 CA-C-O 120.8 0.333 . . . . 74.409999999999997 111.778 -178.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.2 p -111.09 134.2 54.17 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 CA-C-O 121.261 0.553 . . . . 74.540000000000006 111.228 175.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.9 p -130.84 121.1 24.69 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.951 -0.568 . . . . 73.239999999999995 110.224 176.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 17.0 p90 -129.5 129.35 44.44 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.366 0.603 . . . . 64.439999999999998 112.51 -178.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 44.9 m -103.73 119.17 38.36 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.561 -0.745 . . . . 64.409999999999997 110.518 178.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.539 HG12 ' HG3' ' A' ' 3' ' ' MET . 24.2 mt -122.95 133.83 67.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 O-C-N 122.063 -0.398 . . . . 73.420000000000002 112.029 -175.468 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.4 HH21 ' CD ' ' A' ' 2' ' ' GLU . 35.0 ptt180 -127.29 137.03 52.74 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-O 121.122 0.487 . . . . 70.349999999999994 111.155 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.583 HD23 ' H ' ' A' ' 78' ' ' LEU . 2.1 pt? -135.45 165.11 26.26 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 116.037 -0.529 . . . . 71.540000000000006 110.962 178.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -66.5 97.12 0.41 Allowed 'General case' 0 CA--C 1.542 0.639 0 CA-C-O 121.252 0.549 . . . . 74.329999999999998 111.862 -177.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 22.5 p80 -97.16 119.92 36.55 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 116.386 -0.37 . . . . 74.239999999999995 111.279 177.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 57.1 m80 -89.8 117.6 28.77 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.008 0.432 . . . . 75.140000000000001 111.702 -175.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 57.1 t-80 -74.99 75.98 2.2 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.118 0.485 . . . . 73.299999999999997 111.515 -179.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 26.3 p80 -88.18 153.71 21.02 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.321 -0.4 . . . . 64.439999999999998 110.988 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -93.21 -176.54 4.18 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.892 0.377 . . . . 73.430000000000007 111.534 177.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 56.4 t-80 . . . . . 0 C--O 1.252 1.208 0 CA-C-O 118.997 -0.525 . . . . 74.25 111.312 179.628 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.793 ' SD ' ' HD2' ' A' ' 54' ' ' ARG . 35.5 ttm . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 120.705 0.288 . . . . 75.420000000000002 111.022 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.423 ' CD ' HH21 ' A' ' 77' ' ' ARG . 37.6 tt0 -127.2 132.63 50.42 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 120.683 0.278 . . . . 65.420000000000002 110.631 179.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.547 ' HG3' HG12 ' A' ' 76' ' ' ILE . 25.9 ttt -130.14 118.09 20.94 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-O 120.826 0.346 . . . . 73.219999999999999 111.576 -174.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.53 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 13.4 t70 -97.49 114.66 26.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.832 0.453 . . . . 51.299999999999997 110.796 -178.78 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 62.2 mt -121.84 113.54 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 122.372 0.269 . . . . 65.540000000000006 111.462 -177.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.543 ' HB2' ' HG2' ' A' ' 43' ' ' GLU . 6.0 ptm180 -106.93 138.06 43.82 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-O 121.136 0.493 . . . . 73.310000000000002 112.16 -178.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -111.93 142.19 44.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 116.031 -0.531 . . . . 71.129999999999995 110.996 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.525 ' HB3' ' OG1' ' A' ' 71' ' ' THR . 26.4 ttt85 -142.46 132.43 24.41 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 116.591 -0.277 . . . . 74.340000000000003 110.722 179.188 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.46 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -179.37 -165.48 33.61 Favored Glycine 0 CA--C 1.528 0.856 0 C-N-CA 120.441 -0.885 . . . . 75.310000000000002 113.949 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -112.23 -19.91 12.07 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 122.697 0.399 . . . . 74.120000000000005 111.885 179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.3 118.2 8.31 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.18 0.514 . . . . 75.219999999999999 112.353 -178.163 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 65.7 tp -62.06 -61.01 2.78 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-N 115.978 -0.555 . . . . 55.149999999999999 112.352 -178.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.573 ' HG2' ' HG2' ' A' ' 17' ' ' LYS . 43.5 tt0 -60.48 -26.64 66.96 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 112.057 0.391 . . . . 70.049999999999997 112.057 -176.538 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -53.41 -28.79 31.59 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.676 0.274 . . . . 44.030000000000001 111.351 179.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.68 -60.36 3.67 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-N 116.336 -0.393 . . . . 65.049999999999997 111.337 174.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -71.01 -28.57 64.5 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 116.514 -0.312 . . . . 64.230000000000004 111.649 -176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.573 ' HG2' ' HG2' ' A' ' 13' ' ' GLU . 31.8 mmmt -67.76 -54.91 15.46 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.863 0.363 . . . . 74.230000000000004 111.082 177.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.507 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -64.84 -51.59 61.24 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.261 -0.427 . . . . 73.150000000000006 111.437 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.1 tp -53.97 -48.35 70.42 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.901 0.381 . . . . 74.510000000000005 111.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -60.85 -45.98 92.37 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 116.351 -0.386 . . . . 63.549999999999997 111.816 -178.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.513 ' O ' ' HG2' ' A' ' 25' ' ' GLN . 17.3 mm-40 -64.15 -44.92 90.63 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.871 0.322 . . . . 72.340000000000003 111.871 179.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.507 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 96.6 mmm -56.56 -53.09 61.56 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 120.997 0.427 . . . . 63.350000000000001 111.335 178.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.558 ' HA ' HG21 ' A' ' 33' ' ' VAL . 60.9 mt -61.39 -41.07 88.47 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 CA-C-O 121.243 0.544 . . . . 62.32 110.809 176.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.46 -36.6 64.28 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 115.594 -0.73 . . . . 64.329999999999998 111.995 178.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 21' ' ' GLU . 29.7 mm-40 -74.26 -54.18 8.24 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-O 120.997 0.427 . . . . 75.129999999999995 111.663 178.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.2 75.44 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 113.737 1.014 . . . . 73.140000000000001 113.737 -171.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 64.0 mtp85 -56.95 -27.81 61.54 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.232 0.827 . . . . 73.200000000000003 113.232 -174.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.06 -25.91 66.49 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.724 0.297 . . . . 52.329999999999998 111.688 177.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 45.9 m-85 -107.88 -175.37 2.76 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 121.021 0.439 . . . . 70.219999999999999 111.802 -174.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.38 33.5 0.35 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.005 0.431 . . . . 72.049999999999997 111.941 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -109.73 161.83 12.89 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 121.264 -0.493 . . . . 73.409999999999997 113.819 -175.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 53.7 m -132.22 135.96 46.67 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.463 0.305 . . . . 60.200000000000003 110.71 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.558 HG21 ' HA ' ' A' ' 23' ' ' ILE . 95.0 t -98.25 113.86 34.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 CA-C-O 121.044 0.45 . . . . 72.319999999999993 112.15 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 5.0 t -107.91 141.51 39.42 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 116.209 -0.45 . . . . 61.030000000000001 110.225 173.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.461 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 40.1 p90 -150.53 152.01 33.52 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 120.984 0.421 . . . . 74.230000000000004 112.094 -176.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.3 t -132.36 138.58 47.79 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.078 -0.51 . . . . 75.540000000000006 111.5 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -103.18 140.35 37.47 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 120.918 0.389 . . . . 73.430000000000007 112.037 179.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -153.32 99.97 2.4 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 110.93 171.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 58.94 -95.13 0.06 OUTLIER Glycine 0 CA--C 1.529 0.921 0 C-N-CA 121.272 -0.49 . . . . 51.549999999999997 113.392 -179.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.499 HD22 ' HG3' ' A' ' 8' ' ' ARG . 3.1 p-10 -111.31 4.65 19.24 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 112.062 0.393 . . . . 74.230000000000004 112.062 -177.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -108.47 137.68 46.03 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.321 0.582 . . . . 54.149999999999999 112.477 -178.264 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 tp -134.3 99.46 4.39 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 115.36 -0.836 . . . . 73.329999999999998 110.452 176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 6' ' ' ARG . 31.7 mt-10 -93.0 115.97 28.62 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.162 -0.337 . . . . 71.109999999999999 111.217 -179.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 74.1 mt -114.11 109.93 30.26 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-N 116.243 -0.435 . . . . 75.439999999999998 111.907 -176.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.4 ttp180 -106.53 132.13 52.89 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 122.002 -0.436 . . . . 73.239999999999995 111.354 178.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.535 HG12 HG22 ' A' ' 33' ' ' VAL . 45.8 mt -107.63 114.35 46.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 CA-C-O 121.082 0.468 . . . . 74.140000000000001 110.805 176.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 91.7 m -101.61 122.35 43.7 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 116.272 -0.422 . . . . 74.219999999999999 111.846 -178.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 102.85 49.6 1.15 Allowed Glycine 0 CA--C 1.53 1.011 0 C-N-CA 121.251 -0.5 . . . . 61.340000000000003 114.335 174.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 28.3 m -122.81 144.91 43.96 Favored Pre-proline 0 N--CA 1.472 0.65 0 O-C-N 122.233 -0.569 . . . . 71.519999999999996 112.269 178.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -75.39 160.06 39.28 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.03 2.487 . . . . 74.230000000000004 112.109 172.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -62.39 -36.94 83.89 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 121.994 -0.441 . . . . 72.409999999999997 111.955 -177.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 20.2 pt20 -61.11 -19.99 62.12 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.122 0.487 . . . . 75.310000000000002 111.183 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.3 t -95.75 -36.5 6.65 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-N 116.063 -0.517 . . . . 62.210000000000001 110.889 175.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.793 ' HD2' ' SD ' ' A' ' 1' ' ' MET . 31.4 ttt180 -45.55 -53.08 9.52 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.242 0.544 . . . . 71.430000000000007 111.528 173.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 64.1 mttm -58.77 -34.12 71.07 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 115.915 -0.584 . . . . 74.040000000000006 111.674 179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -75.54 -35.26 60.72 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.285 -0.416 . . . . 71.230000000000004 111.428 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 90.7 mt -62.84 -45.04 94.47 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.076 0.465 . . . . 74.510000000000005 110.849 176.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.497 ' O ' ' HG2' ' A' ' 62' ' ' GLU . . . -60.76 -50.42 73.55 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.149 -0.478 . . . . 71.040000000000006 111.159 175.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -55.17 -36.8 66.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-N 116.156 -0.475 . . . . 70.140000000000001 112.21 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 tp10 -75.12 -43.89 50.2 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-O 120.975 0.417 . . . . 71.010000000000005 111.112 178.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -59.06 -38.05 78.5 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.755 0.312 . . . . 61.229999999999997 111.78 178.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 58' ' ' ALA . 7.1 mm-40 -53.38 -46.34 69.61 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-O 120.971 0.415 . . . . 74.299999999999997 111.047 175.928 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 9.7 ttm-85 -61.67 -50.93 70.52 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 120.965 0.412 . . . . 75.349999999999994 110.694 178.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.83 -43.88 66.32 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.908 -0.587 . . . . 73.219999999999999 111.778 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.468 ' HA ' HG13 ' A' ' 70' ' ' ILE . . . -66.18 -57.32 7.88 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.012 0.434 . . . . 52.340000000000003 111.981 179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -62.67 -43.07 99.75 Favored 'General case' 0 CA--C 1.54 0.569 0 N-CA-C 112.43 0.53 . . . . 75.209999999999994 112.43 -175.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -62.43 -36.86 83.71 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-O 120.953 0.406 . . . . 75.530000000000001 111.804 -174.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -106.33 7.69 31.38 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.844 0.313 . . . . 65.129999999999995 111.844 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 33.3 m-80 58.38 27.69 15.74 Favored 'General case' 0 N--CA 1.474 0.765 0 CA-C-O 121.028 0.442 . . . . 65.109999999999999 112.01 178.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.468 HG13 ' HA ' ' A' ' 65' ' ' ALA . 24.5 pt -96.25 154.84 3.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.534 0 CA-C-O 121.056 0.455 . . . . 72.230000000000004 111.062 178.402 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.525 ' OG1' ' HB3' ' A' ' 8' ' ' ARG . 45.8 p -88.31 143.14 27.2 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 120.959 0.409 . . . . 52.210000000000001 111.88 -178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.445 ' HA ' ' O ' ' A' ' 6' ' ' ARG . 12.1 p -141.88 135.6 29.59 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 CA-C-O 121.18 0.514 . . . . 75.25 112.172 -177.356 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 60.7 p -128.75 143.22 50.87 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.371 -0.377 . . . . 72.340000000000003 110.014 172.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.53 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 21.0 p90 -131.35 115.33 16.11 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.394 0.616 . . . . 73.239999999999995 112.279 -179.151 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 96.6 m -104.19 124.93 50.0 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.729 -0.669 . . . . 74.219999999999999 110.418 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.547 HG12 ' HG3' ' A' ' 3' ' ' MET . 44.3 mt -118.64 139.81 44.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.461 0 CA-C-O 121.131 0.491 . . . . 73.530000000000001 112.237 -174.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.423 HH21 ' CD ' ' A' ' 2' ' ' GLU . 18.8 ptt180 -126.43 131.23 51.74 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 116.117 -0.492 . . . . 62.420000000000002 110.636 174.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 2.1 pp -134.85 168.76 18.47 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 112.697 0.628 . . . . 72.400000000000006 112.697 -173.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -66.75 85.64 0.12 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.937 -0.574 . . . . 75.150000000000006 111.913 179.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -72.69 126.01 28.87 Favored 'General case' 0 CA--C 1.54 0.576 0 CA-C-O 120.915 0.388 . . . . 73.099999999999994 111.088 177.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -78.32 151.29 33.02 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 121.199 0.523 . . . . 74.310000000000002 112.33 -175.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 46.7 t60 -104.35 106.74 17.35 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.811 -0.631 . . . . 65.200000000000003 111.071 -178.348 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.7 m170 -111.94 -75.42 0.61 Allowed 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.649 0.611 . . . . 73.510000000000005 112.649 -177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 62.49 35.71 14.5 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.205 0.526 . . . . 63.420000000000002 111.287 -173.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 37.9 m80 . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.769 -0.634 . . . . 73.239999999999995 111.284 178.513 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.7 ' SD ' ' HD3' ' A' ' 54' ' ' ARG . 47.5 ttp . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 120.715 0.293 . . . . 75.540000000000006 111.144 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.529 ' CD ' HH21 ' A' ' 45' ' ' ARG . 40.4 mt-10 -132.31 142.41 49.35 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.966 0.412 . . . . 75.519999999999996 111.36 177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 ptm -133.06 118.63 18.99 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.289 0.566 . . . . 74.209999999999994 111.294 178.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -100.73 114.43 28.19 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.744 -0.662 . . . . 72.099999999999994 110.814 -178.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.1 mt -106.39 120.42 57.45 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 CA-C-O 121.264 0.554 . . . . 74.409999999999997 111.365 -178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -103.7 105.32 15.51 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.067 -0.515 . . . . 72.140000000000001 111.747 -174.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -93.56 146.98 23.4 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-O 121.156 0.503 . . . . 74.230000000000004 111.974 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -143.03 120.78 11.88 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.304 -0.407 . . . . 71.150000000000006 110.674 171.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -162.65 156.52 28.23 Favored Glycine 0 CA--C 1.521 0.433 0 C-N-CA 120.776 -0.726 . . . . 63.520000000000003 112.94 -179.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -89.1 -30.15 18.86 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-O 120.807 0.336 . . . . 74.230000000000004 111.412 179.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -65.9 120.53 13.24 Favored 'General case' 0 CA--C 1.542 0.642 0 CA-C-O 120.948 0.404 . . . . 62.439999999999998 111.793 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 48.1 tp -63.75 -41.27 98.04 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.993 0.425 . . . . 54.140000000000001 111.316 -178.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -57.09 -36.8 71.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.088 177.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -58.59 -40.56 83.53 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 116.332 -0.395 . . . . 75.409999999999997 111.423 178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.428 ' HB3' ' O ' ' A' ' 12' ' ' LEU . 15.3 t80 -53.72 -58.68 6.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.193 -0.458 . . . . 72.340000000000003 111.74 176.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -70.69 -40.58 72.82 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.001 0.371 . . . . 72.219999999999999 112.001 -175.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.403 ' HA ' ' HD3' ' A' ' 17' ' ' LYS . 67.9 mmtt -62.98 -46.7 86.45 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 112.393 0.516 . . . . 65.239999999999995 112.393 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.553 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.83 -49.05 79.03 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 120.902 0.382 . . . . 52.439999999999998 111.104 178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 60.2 tp -61.24 -41.02 96.17 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.128 0.489 . . . . 65.310000000000002 111.177 176.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 59.7 tptt -58.99 -54.86 42.42 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.768 -0.651 . . . . 74.329999999999998 111.802 -178.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.99 -42.47 97.18 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.209 0.448 . . . . 72.010000000000005 112.209 -176.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.553 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 85.3 mmm -57.66 -48.57 79.13 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 122.119 -0.363 . . . . 73.299999999999997 111.148 178.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.503 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 63.0 mt -66.47 -38.44 81.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-O 121.212 0.53 . . . . 74.510000000000005 110.863 175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 80.0 ttt180 -54.56 -48.39 72.11 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.633 -0.712 . . . . 63.439999999999998 111.624 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -73.89 -40.92 62.83 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 120.641 0.258 . . . . 73.439999999999998 111.58 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.13 -29.97 64.03 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 112.856 0.687 . . . . 74.420000000000002 112.856 -177.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 60.5 mtp180 -56.77 -29.57 62.77 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 112.378 0.51 . . . . 74.239999999999995 112.378 179.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' NZ ' ' HB3' ' A' ' 28' ' ' LYS . 3.5 mmmp? -75.26 -13.27 60.42 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.038 0.447 . . . . 72.239999999999995 111.715 179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -120.54 178.73 4.56 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 121.07 0.462 . . . . 73.239999999999995 111.281 -177.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.99 38.0 0.33 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 121.193 0.52 . . . . 72.239999999999995 111.505 175.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -91.35 124.64 7.68 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 114.345 0.498 . . . . 71.409999999999997 114.345 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 88.8 m -101.38 117.76 35.6 Favored 'General case' 0 N--CA 1.468 0.46 0 C-N-CA 122.691 0.396 . . . . 65.450000000000003 109.997 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.416 HG22 HG12 ' A' ' 46' ' ' ILE . 49.0 t -108.13 130.94 59.81 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 CA-C-O 120.956 0.408 . . . . 63.43 112.047 -176.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 10.2 t -132.74 161.2 34.65 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 116.296 -0.411 . . . . 74.319999999999993 110.972 174.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.46 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 28.4 p90 -151.36 152.76 33.57 Favored 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 112.575 0.583 . . . . 72.109999999999999 112.575 -175.001 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 2.9 t -137.15 134.69 36.64 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.815 -0.63 . . . . 74.420000000000002 111.045 175.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.427 HD21 ' HE1' ' A' ' 15' ' ' PHE . 4.2 mm? -99.36 139.96 34.24 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.246 0.546 . . . . 73.400000000000006 112.3 -178.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -142.89 86.0 1.91 Allowed 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 115.971 -0.558 . . . . 75.299999999999997 110.529 174.021 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 56.56 -89.76 0.01 OUTLIER Glycine 0 CA--C 1.529 0.916 0 C-N-CA 121.367 -0.444 . . . . 70.129999999999995 113.481 -178.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -95.44 -25.76 16.12 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.691 0.397 . . . . 62.240000000000002 111.781 -177.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -93.16 147.22 23.07 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 121.539 0.685 . . . . 75.219999999999999 112.659 -171.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.404 HD21 HD11 ' A' ' 44' ' ' ILE . 43.3 tp -134.95 104.33 5.93 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.158 -0.928 . . . . 71.140000000000001 110.192 178.374 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.46 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 39.3 tt0 -94.35 111.08 22.8 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 120.701 0.286 . . . . 73.420000000000002 111.107 -178.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.404 HD11 HD21 ' A' ' 42' ' ' LEU . 65.8 mt -112.78 109.85 30.07 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.625 0 CA-C-N 116.435 -0.348 . . . . 70.120000000000005 111.341 -179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.529 HH21 ' CD ' ' A' ' 2' ' ' GLU . 61.8 ttt180 -104.64 120.01 40.33 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 120.981 0.419 . . . . 74.540000000000006 111.145 -178.035 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.416 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -106.95 125.89 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-O 120.936 0.398 . . . . 75.329999999999998 111.299 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 2' ' ' GLU . 77.7 m -121.34 136.59 54.94 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.346 -0.388 . . . . 34.43 111.762 -177.398 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 107.19 -13.94 40.24 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 120.755 -0.736 . . . . 71.239999999999995 114.193 174.394 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 17.3 m -66.35 138.1 95.72 Favored Pre-proline 0 CA--C 1.544 0.748 0 CA-C-N 117.268 0.534 . . . . 75.349999999999994 111.837 179.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.475 ' HG2' HG23 ' A' ' 53' ' ' VAL . 42.7 Cg_endo -68.8 152.6 73.91 Favored 'Trans proline' 0 CA--C 1.544 0.977 0 C-N-CA 122.382 2.055 . . . . 72.140000000000001 113.361 179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -45.24 -43.11 10.12 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 113.836 1.05 . . . . 75.310000000000002 113.836 -176.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.21 -37.66 87.99 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 112.642 0.608 . . . . 70.400000000000006 112.642 -176.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.532 HG12 ' HG ' ' A' ' 57' ' ' LEU . 57.6 t -73.89 -23.51 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-O 121.025 0.441 . . . . 74.200000000000003 111.708 -177.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.7 ' HD3' ' SD ' ' A' ' 1' ' ' MET . 42.8 ttp180 -46.68 -50.52 17.71 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.334 0.588 . . . . 74.040000000000006 111.708 176.282 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 7.1 mtpm? -59.27 -44.77 92.42 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.244 -0.889 . . . . 70.219999999999999 112.029 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -68.95 -48.42 63.25 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.038 -0.528 . . . . 64.519999999999996 111.67 -175.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.532 ' HG ' HG12 ' A' ' 53' ' ' VAL . 87.1 mt -59.66 -33.85 72.08 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-O 120.555 0.217 . . . . 72.319999999999993 111.524 179.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -61.82 -47.47 84.96 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.194 0.521 . . . . 61.310000000000002 110.594 173.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 24.7 ttpp -57.45 -45.46 84.73 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 115.752 -0.658 . . . . 72.400000000000006 111.226 174.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.98 95.67 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.49 -0.323 . . . . 74.340000000000003 111.79 177.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.37 -42.55 87.26 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-O 121.102 0.477 . . . . 45.329999999999998 111.291 177.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -65.29 -42.4 93.17 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 116.222 -0.444 . . . . 74.239999999999995 111.336 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 29.9 ttp180 -64.92 -37.96 89.37 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 120.734 0.302 . . . . 52.109999999999999 111.139 177.332 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 65.8 mt -57.38 -43.22 83.41 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.947 0.404 . . . . 65.349999999999994 110.65 172.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.98 -51.52 69.33 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.072 -0.513 . . . . 74.349999999999994 111.776 177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -67.79 -26.24 65.99 Favored 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 112.222 0.453 . . . . 72.030000000000001 112.222 -179.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -57.94 -50.56 72.97 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-O 120.949 0.404 . . . . 64.409999999999997 111.63 178.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -108.54 7.27 26.69 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 112.17 0.433 . . . . 74.200000000000003 112.17 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.8 t30 58.57 66.61 1.05 Allowed 'General case' 0 CA--C 1.543 0.699 0 CA-C-O 121.321 0.581 . . . . 74.430000000000007 111.356 -179.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 31.8 pt -130.46 172.23 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 116.17 -0.468 . . . . 70.129999999999995 111.23 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.7 m -96.34 135.68 37.85 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 116.585 -0.279 . . . . 74.230000000000004 111.324 -179.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 14.7 p -144.29 138.76 24.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 CA-C-O 121.171 0.51 . . . . 60.219999999999999 112.118 179.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 44.6 p -127.43 172.87 10.28 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.999 -0.546 . . . . 63.240000000000002 109.742 172.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 28.6 p90 -145.92 115.77 7.32 Favored 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.364 0.602 . . . . 70.109999999999999 112.451 179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 97.4 m -93.18 104.54 16.72 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.689 -0.687 . . . . 64.319999999999993 110.139 173.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.498 HG21 ' HD2' ' A' ' 54' ' ' ARG . 52.8 mt -111.93 129.42 67.41 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 CA-C-O 120.947 0.403 . . . . 65.430000000000007 111.811 -175.533 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -100.25 106.65 18.33 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.177 0.513 . . . . 65.340000000000003 111.086 179.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -142.51 110.66 5.99 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 115.915 -0.584 . . . . 72.219999999999999 109.692 179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.436 ' HB2' ' HD2' ' A' ' 81' ' ' HIS . 8.8 pt-20 -73.85 148.98 41.87 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.304 0.573 . . . . 75.439999999999998 112.538 -176.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 37.3 t-80 -127.77 80.72 1.98 Allowed 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.914 -0.584 . . . . 75.230000000000004 110.754 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . 0.436 ' HD2' ' HB2' ' A' ' 79' ' ' GLU . 31.3 m-70 -98.36 102.45 14.19 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 121.307 0.575 . . . . 74.010000000000005 112.015 -178.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -146.99 173.47 12.41 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.653 -0.703 . . . . 73.299999999999997 110.258 176.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 64.5 t60 -136.38 15.21 3.21 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.178 0.513 . . . . 72.019999999999996 110.9 176.411 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -155.61 2.99 0.18 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 116.105 -0.498 . . . . 73.120000000000005 111.876 -177.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 84.7 t60 . . . . . 0 C--O 1.252 1.194 0 CA-C-O 118.998 -0.525 . . . . 61.020000000000003 111.61 -179.104 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 81.1 mtp . . . . . 0 N--CA 1.487 1.409 0 CA-C-O 120.944 0.402 . . . . 73.530000000000001 111.358 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -115.11 148.02 39.49 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 116.244 -0.435 . . . . 70.530000000000001 110.949 179.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.505 ' HG3' HG12 ' A' ' 76' ' ' ILE . 27.1 ttt -130.6 107.69 9.37 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-O 121.182 0.515 . . . . 71.140000000000001 111.663 -179.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.511 ' O ' ' HA ' ' A' ' 74' ' ' TYR . 2.9 m-20 -81.91 104.6 12.39 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 115.875 -0.602 . . . . 72.129999999999995 111.158 176.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.7 mt -107.74 109.41 28.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 120.99 0.424 . . . . 70.239999999999995 111.281 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.73 107.06 18.16 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 116.568 -0.287 . . . . 72.450000000000003 111.549 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -89.03 138.56 31.3 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.553 -0.294 . . . . 74.109999999999999 110.226 172.223 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -137.54 120.29 16.28 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-O 120.806 0.336 . . . . 64.319999999999993 110.615 175.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.4 149.53 16.08 Favored Glycine 0 CA--C 1.522 0.487 0 C-N-CA 121.053 -0.594 . . . . 55.340000000000003 112.938 -178.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -87.04 23.67 1.72 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 120.831 0.348 . . . . 63.310000000000002 111.648 -178.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -119.53 120.84 37.92 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-O 120.888 0.375 . . . . 72.420000000000002 111.393 -175.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.405 ' O ' ' HB3' ' A' ' 15' ' ' PHE . 49.9 tp -72.23 -38.25 68.98 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 112.153 0.427 . . . . 64.319999999999993 112.153 -176.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.45 -40.4 93.2 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 120.88 0.372 . . . . 74.340000000000003 111.221 178.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.4 -43.32 83.62 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 116.164 -0.471 . . . . 72.230000000000004 111.156 175.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.553 ' HE1' HD13 ' A' ' 42' ' ' LEU . 56.6 t80 -50.03 -55.31 15.28 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 115.684 -0.689 . . . . 63.140000000000001 111.577 176.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -62.64 -56.28 19.22 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.975 0.361 . . . . 73.129999999999995 111.975 -177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -61.97 -49.29 76.7 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 112.674 0.62 . . . . 71.239999999999995 112.674 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' O ' ' HG2' ' A' ' 22' ' ' MET . . . -60.46 -48.38 82.03 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 120.974 0.416 . . . . 64.230000000000004 111.574 -179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 65.9 tp -62.76 -43.39 98.92 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.045 0.45 . . . . 74.25 111.473 177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -57.95 -47.85 81.68 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.88 -0.6 . . . . 62.210000000000001 111.763 -177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.0 mm-40 -66.66 -33.15 75.01 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 112.372 0.508 . . . . 72.040000000000006 112.372 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.42 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 93.4 mmm -66.07 -47.61 73.7 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 120.976 0.417 . . . . 73.420000000000002 110.895 176.435 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 62.7 mt -65.71 -39.55 85.23 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 116.282 -0.417 . . . . 72.239999999999995 111.033 177.526 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 41.0 ttm-85 -54.58 -45.45 73.56 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 121.138 0.494 . . . . 73.040000000000006 111.204 179.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -72.45 -45.92 57.33 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 116.235 -0.439 . . . . 53.439999999999998 111.548 178.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.82 -34.96 70.22 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 112.245 0.461 . . . . 71.409999999999997 112.245 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -58.44 -28.72 65.55 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 112.043 0.386 . . . . 75.409999999999997 112.043 177.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.7 mtpp -66.21 -33.66 76.26 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-O 121.13 0.491 . . . . 74.120000000000005 111.228 176.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -96.54 -178.03 4.13 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 111.425 -177.438 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -87.18 4.12 43.71 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 112.21 0.448 . . . . 72.129999999999995 112.21 179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -80.91 159.62 42.02 Favored Glycine 0 CA--C 1.528 0.872 0 C-N-CA 121.186 -0.53 . . . . 50.32 113.812 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.7 m -119.1 144.49 46.58 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 122.609 -0.348 . . . . 52.009999999999998 110.767 178.993 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.401 HG22 HG12 ' A' ' 46' ' ' ILE . 64.5 t -117.7 124.43 73.05 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 112.036 0.384 . . . . 71.420000000000002 112.036 -177.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 9.7 t -118.31 148.69 42.22 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.441 -0.345 . . . . 63.43 110.483 172.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.403 ' HB2' HD11 ' A' ' 42' ' ' LEU . 52.7 p90 -150.71 138.25 19.66 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-O 121.113 0.483 . . . . 73.430000000000007 112.138 -177.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 65.2 p -123.88 119.78 30.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 116.09 -0.504 . . . . 54.219999999999999 110.808 176.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 57.4 tp -93.73 101.47 13.6 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.119 0.485 . . . . 74.140000000000001 111.629 -179.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -99.04 96.88 8.1 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 116.122 -0.49 . . . . 74.219999999999999 110.773 178.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 65.64 -90.33 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 C-N-CA 121.3 -0.476 . . . . 64.140000000000001 113.154 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -119.6 -1.04 10.69 Favored 'General case' 0 N--CA 1.472 0.663 0 CA-C-O 120.855 0.36 . . . . 73.5 111.11 179.354 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -105.15 121.81 44.59 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 116.273 -0.421 . . . . 75.400000000000006 111.396 -177.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.553 HD13 ' HE1' ' A' ' 15' ' ' PHE . 64.6 tp -104.02 99.67 9.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 121.177 0.513 . . . . 73.420000000000002 110.659 176.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -85.28 104.52 15.2 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 116.215 -0.448 . . . . 72.340000000000003 111.197 179.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 57.5 mt -103.48 136.41 36.47 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 CA-C-N 116.346 -0.388 . . . . 73.540000000000006 111.395 179.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 33.7 mtp85 -125.39 115.6 20.55 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 120.943 0.401 . . . . 71.049999999999997 110.771 172.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.401 HG12 HG22 ' A' ' 33' ' ' VAL . 51.6 mt -101.64 115.3 43.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 CA-C-O 121.036 0.446 . . . . 73.430000000000007 110.689 178.288 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 21.9 m -101.43 123.68 45.88 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 116.284 -0.416 . . . . 74.129999999999995 111.6 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 90.22 65.01 1.22 Allowed Glycine 0 CA--C 1.527 0.798 0 C-N-CA 121.091 -0.576 . . . . 73.109999999999999 113.46 176.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 9.6 m -113.85 133.87 22.2 Favored Pre-proline 0 CA--C 1.54 0.568 0 O-C-N 122.551 -0.382 . . . . 71.109999999999999 111.923 178.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.453 ' HG2' ' HB ' ' A' ' 53' ' ' VAL . 37.5 Cg_endo -65.57 125.78 14.98 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 122.578 2.186 . . . . 73.319999999999993 112.837 178.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -54.7 -34.44 62.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 112.483 0.549 . . . . 75.430000000000007 112.483 -176.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.528 ' HG3' HG23 ' A' ' 53' ' ' VAL . 13.7 pt20 -63.92 -40.02 95.5 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 120.737 0.303 . . . . 65.310000000000002 111.763 179.732 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.528 HG23 ' HG3' ' A' ' 52' ' ' GLN . 58.4 t -86.75 -19.07 8.28 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-O 120.816 0.341 . . . . 73.120000000000005 111.498 -178.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HD2' HD13 ' A' ' 76' ' ' ILE . 16.4 ttp180 -48.81 -36.35 16.55 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 112.287 0.477 . . . . 63.140000000000001 112.287 -178.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -61.42 -40.97 96.37 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-O 120.879 0.371 . . . . 65.230000000000004 111.481 177.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -69.84 -35.94 75.15 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-O 120.798 0.333 . . . . 70.450000000000003 111.042 177.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 92.6 mt -65.44 -43.2 91.15 Favored 'General case' 0 CA--C 1.538 0.489 0 CA-C-O 121.057 0.456 . . . . 53.240000000000002 110.853 176.318 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.53 94.43 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.243 0.544 . . . . 75.329999999999998 110.865 175.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 27.9 ttpt -59.64 -50.74 72.7 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.025 -0.534 . . . . 63.030000000000001 111.189 174.527 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -69.64 -37.8 76.93 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.94 -0.573 . . . . 63.43 111.713 -174.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -52.17 -51.82 55.68 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.042 0.449 . . . . 60.32 111.493 178.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' A' ' 66' ' ' LYS . 42.2 mt-10 -72.92 -31.49 64.67 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 116.484 -0.326 . . . . 63.240000000000002 111.357 176.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.407 ' HD3' ' O ' ' A' ' 63' ' ' ARG . 0.0 OUTLIER -57.3 -48.67 78.33 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.882 0.372 . . . . 72.310000000000002 110.306 178.419 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 88.9 mt -52.79 -47.3 67.68 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 115.991 -0.549 . . . . 63.329999999999998 111.188 175.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.81 -42.06 83.46 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.051 -0.522 . . . . 75.540000000000006 111.874 178.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 62.1 mttm -68.64 -26.61 65.42 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 116.404 -0.362 . . . . 73.140000000000001 111.664 -178.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -68.55 -48.99 62.84 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.198 0.523 . . . . 72.329999999999998 111.198 174.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -96.14 1.33 52.3 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 112.487 0.551 . . . . 62.420000000000002 112.487 -175.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 61.72 26.17 15.88 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 112.084 0.401 . . . . 71.329999999999998 112.084 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 2.9 pp -103.65 175.58 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.797 0 CA-C-O 121.215 0.531 . . . . 63.32 112.425 -176.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.8 m -97.3 139.73 32.83 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 112.042 -176.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 13.0 p -146.37 137.28 18.55 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.647 0 CA-C-O 120.978 0.418 . . . . 73.109999999999999 111.663 176.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 41.4 p -128.66 139.11 52.41 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 116.664 -0.244 . . . . 53.450000000000003 110.594 175.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . 0.511 ' HA ' ' O ' ' A' ' 4' ' ' ASP . 43.5 p90 -127.27 119.38 26.21 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.363 0.601 . . . . 74.439999999999998 112.476 -178.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . 0.443 ' HB ' ' HB2' ' A' ' 4' ' ' ASP . 71.7 m -103.55 139.81 38.37 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.733 -0.667 . . . . 74.329999999999998 109.714 173.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.505 HG12 ' HG3' ' A' ' 3' ' ' MET . 56.3 mt -131.15 128.49 62.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 121.864 -0.522 . . . . 75.140000000000001 112.408 -177.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 76.7 mtp180 -85.82 105.69 16.51 Favored 'General case' 0 CA--C 1.538 0.511 0 N-CA-C 109.884 -0.413 . . . . 75.439999999999998 109.884 173.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 5.7 tt -100.8 124.86 47.07 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.118 0.485 . . . . 75.430000000000007 111.174 -174.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -91.17 104.77 17.29 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.936 -0.574 . . . . 74.420000000000002 110.976 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 47.2 t-80 -124.25 143.13 50.72 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.011 0.434 . . . . 62.149999999999999 111.851 -177.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 71.3 m80 -86.16 137.45 32.64 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 116.276 -0.42 . . . . 70.530000000000001 111.082 177.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 44.9 t60 -144.5 105.37 4.17 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.605 0.24 . . . . 61.100000000000001 111.344 -177.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.4 m80 -80.41 151.22 29.48 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.232 0.539 . . . . 74.230000000000004 111.942 178.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 50.2 t-80 -149.09 136.65 20.31 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 115.876 -0.602 . . . . 72.430000000000007 111.052 178.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.708 -0.663 . . . . 72.329999999999998 111.403 178.931 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.516 ' HE1' ' HA ' ' A' ' 51' ' ' GLU . 55.4 ttp . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 120.994 0.426 . . . . 72.150000000000006 111.532 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -129.07 146.3 51.06 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.573 178.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.0 ptm -131.65 121.95 25.15 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 112.9 0.704 . . . . 61.350000000000001 112.9 -175.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.55 ' HB3' ' NH1' ' A' ' 6' ' ' ARG . 3.8 m-20 -86.01 134.9 33.83 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.868 -0.605 . . . . 74.209999999999994 111.545 173.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 59.3 mt -139.24 133.24 39.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 C-N-CA 123.101 0.56 . . . . 73.329999999999998 110.055 173.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.55 ' NH1' ' HB3' ' A' ' 4' ' ' ASP . 49.9 mtt85 -132.84 113.23 12.66 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.974 0.416 . . . . 72.319999999999993 112.02 -175.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.516 ' HE1' ' SD ' ' A' ' 22' ' ' MET . 97.0 m-85 -93.25 142.55 27.19 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 116.305 -0.407 . . . . 61.439999999999998 110.9 177.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.447 HH11 ' HD2' ' A' ' 8' ' ' ARG . 21.1 ttt180 -142.37 127.13 18.12 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-O 120.536 0.208 . . . . 70.239999999999995 111.514 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.558 ' HA3' HG22 ' A' ' 70' ' ' ILE . . . -170.27 -175.37 39.07 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 120.842 -0.694 . . . . 61.329999999999998 113.948 -178.348 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -95.2 -50.88 4.86 Favored 'General case' 0 CA--C 1.54 0.559 0 N-CA-C 111.986 0.365 . . . . 74.109999999999999 111.986 -176.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -61.36 114.48 3.22 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-O 120.9 0.381 . . . . 73.109999999999999 111.049 178.601 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 44.3 tp -58.55 -50.42 73.86 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 112.645 0.609 . . . . 64.209999999999994 112.645 -173.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.419 ' HA ' ' HG2' ' A' ' 16' ' ' GLU . 22.0 mt-10 -56.23 -25.42 47.43 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 112.855 0.687 . . . . 72.540000000000006 112.855 -178.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.08 -34.02 59.08 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-O 120.754 0.311 . . . . 74.319999999999993 111.608 -179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.498 ' HB3' HD22 ' A' ' 42' ' ' LEU . 78.6 m-85 -72.05 -60.2 2.35 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 116.505 -0.316 . . . . 65.230000000000004 111.476 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' A' ' 13' ' ' GLU . 10.9 pt-20 -57.67 -40.67 79.9 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 112.122 0.416 . . . . 73.340000000000003 112.122 -178.777 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -70.21 -42.45 72.32 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 112.1 0.407 . . . . 73.549999999999997 112.1 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.26 -46.72 82.48 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.211 0.529 . . . . 64.430000000000007 110.415 174.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.427 ' HB2' HD21 ' A' ' 42' ' ' LEU . 64.3 tp -56.05 -43.57 78.0 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 115.69 -0.686 . . . . 72.099999999999994 111.247 175.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -56.14 -46.11 79.36 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.062 -0.517 . . . . 74.409999999999997 111.498 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.8 mm-40 -65.99 -40.26 91.05 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.714 0.292 . . . . 65.340000000000003 111.677 178.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' MET . . . . . 0.516 ' SD ' ' HE1' ' A' ' 7' ' ' PHE . 80.8 mtp -61.37 -53.29 58.52 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 120.72 0.295 . . . . 74.019999999999996 111.202 177.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.613 ' O ' ' HG3' ' A' ' 27' ' ' ARG . 69.1 mt -59.49 -42.31 87.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-O 120.931 0.396 . . . . 74.010000000000005 110.506 176.287 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -48.41 -50.34 31.4 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.948 -0.569 . . . . 65.310000000000002 111.562 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -75.14 -33.02 61.48 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-O 120.913 0.387 . . . . 62.030000000000001 111.663 178.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -65.31 -31.9 73.27 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 112.384 0.512 . . . . 61.350000000000001 112.384 -178.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.613 ' HG3' ' O ' ' A' ' 23' ' ' ILE . 43.3 mtp180 -63.91 -27.84 69.42 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 120.93 0.395 . . . . 73.519999999999996 111.333 178.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -57.13 -25.03 58.17 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 116.136 -0.484 . . . . 74.120000000000005 111.486 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 86.6 m-85 -120.16 167.74 11.92 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 120.988 0.423 . . . . 75.340000000000003 110.999 178.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.13 87.27 7.15 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-O 121.084 0.469 . . . . 54.109999999999999 110.748 176.6 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -146.42 157.68 27.47 Favored Glycine 0 CA--C 1.525 0.695 0 C-N-CA 120.836 -0.697 . . . . 72.030000000000001 113.474 -178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 86.9 m -106.98 128.81 54.68 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 122.793 -0.24 . . . . 72.519999999999996 111.276 -179.518 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 60.8 t -110.6 109.38 28.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 CA-C-O 120.77 0.319 . . . . 73.230000000000004 111.33 178.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 30.6 p -101.06 130.46 47.09 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.392 0.277 . . . . 61.340000000000003 110.286 177.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.519 ' HA ' ' O ' ' A' ' 43' ' ' GLU . 47.5 p90 -144.01 150.2 37.88 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.66 0.615 . . . . 71.549999999999997 112.66 -178.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 10.0 t -139.28 133.59 31.44 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.993 -0.548 . . . . 71.349999999999994 111.398 171.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 32.8 tp -95.28 106.33 18.35 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-O 121.018 0.437 . . . . 71.010000000000005 110.483 175.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -126.82 118.23 24.22 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-O 121.023 0.44 . . . . 52.43 111.411 -172.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 66.04 -101.4 0.6 Allowed Glycine 0 CA--C 1.529 0.909 0 C-N-CA 121.338 -0.458 . . . . 74.400000000000006 113.049 179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -122.1 6.1 9.77 Favored 'General case' 0 N--CA 1.473 0.723 0 CA-C-O 120.824 0.345 . . . . 71.430000000000007 111.089 176.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -114.82 139.51 49.68 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-O 121.357 0.598 . . . . 71.329999999999998 112.067 -176.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.498 HD22 ' HB3' ' A' ' 15' ' ' PHE . 64.7 tp -108.02 101.72 10.95 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 116.102 -0.499 . . . . 72.010000000000005 109.84 172.065 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.519 ' O ' ' HA ' ' A' ' 35' ' ' TYR . 7.9 tm-20 -81.52 115.04 20.64 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.925 -0.58 . . . . 74.510000000000005 110.556 -177.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 58.4 mt -123.86 129.44 74.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 CA-C-O 120.788 0.327 . . . . 74.209999999999994 111.616 -177.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 ttm180 -126.43 127.5 45.52 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 122.129 -0.357 . . . . 74.340000000000003 111.024 174.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.3 mt -111.89 124.22 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.573 0 CA-C-O 120.976 0.417 . . . . 42.229999999999997 111.122 178.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 90.1 m -105.63 130.72 53.6 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.178 -0.465 . . . . 65.450000000000003 111.953 -177.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 96.67 28.47 8.89 Favored Glycine 0 CA--C 1.529 0.927 0 C-N-CA 121.197 -0.525 . . . . 61.549999999999997 113.832 175.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.484 ' HA ' ' HD3' ' A' ' 50' ' ' PRO . 13.7 m -89.63 134.72 31.81 Favored Pre-proline 0 CA--C 1.543 0.703 0 O-C-N 122.41 -0.465 . . . . 71.319999999999993 111.974 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 49' ' ' VAL . 8.1 Cg_exo -74.9 144.77 31.04 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 122.862 2.375 . . . . 60.130000000000003 113.023 177.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.516 ' HA ' ' HE1' ' A' ' 1' ' ' MET . 3.1 tm-20 -53.2 -48.43 68.11 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-O 120.98 0.419 . . . . 72.340000000000003 111.28 -179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.427 ' HG3' HG23 ' A' ' 53' ' ' VAL . 20.6 pt20 -56.13 -28.63 58.65 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 112.367 0.506 . . . . 74.120000000000005 112.367 179.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.427 HG23 ' HG3' ' A' ' 52' ' ' GLN . 46.4 t -94.92 -22.87 5.26 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 120.965 0.412 . . . . 74.329999999999998 111.262 -179.36 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.435 ' NH1' ' HG2' ' A' ' 51' ' ' GLU . 23.2 ttp180 -50.84 -49.4 58.94 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.142 0.496 . . . . 73.140000000000001 111.598 179.575 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.3 ptmm? -54.77 -40.84 69.79 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.573 -0.74 . . . . 63.310000000000002 111.968 178.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -70.5 -44.87 66.75 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 116.414 -0.357 . . . . 74.209999999999994 111.437 -179.248 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.409 ' HG ' HG12 ' A' ' 53' ' ' VAL . 94.4 mt -63.98 -42.96 97.06 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 120.773 0.32 . . . . 64.519999999999996 111.77 179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -62.95 -50.04 72.36 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.894 0.378 . . . . 51.109999999999999 111.136 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.406 ' HE2' ' HB3' ' A' ' 59' ' ' LYS . 2.7 tmmm? -56.72 -47.55 79.73 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.135 -0.484 . . . . 74.510000000000005 110.531 175.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -59.49 -40.63 87.67 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 116.155 -0.475 . . . . 72.129999999999995 110.96 -178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -58.41 -46.26 86.79 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-O 120.929 0.395 . . . . 71.329999999999998 111.488 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -60.67 -41.61 95.41 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-O 121.069 0.461 . . . . 62.439999999999998 111.049 176.553 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 21.6 ttt180 -63.66 -42.03 98.14 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 116.356 -0.384 . . . . 70.239999999999995 111.289 176.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . . . . . . . . . 85.7 mt -57.25 -48.31 79.19 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-O 120.997 0.427 . . . . 63.119999999999997 111.179 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.413 ' HB2' ' HB ' ' A' ' 72' ' ' VAL . . . -53.53 -55.63 23.89 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.011 -0.54 . . . . 71.340000000000003 111.321 177.226 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -60.25 -35.47 75.55 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.228 -0.442 . . . . 72.099999999999994 111.975 178.464 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -61.96 -46.53 88.89 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.138 0.494 . . . . 74.129999999999995 111.397 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -93.18 7.58 43.68 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 116.488 -0.324 . . . . 65.510000000000005 111.783 -179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.2 t30 58.82 32.93 22.71 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 121.583 0.706 . . . . 62.32 111.058 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.558 HG22 ' HA3' ' A' ' 9' ' ' GLY . 20.3 pt -111.78 164.09 8.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 116.178 -0.464 . . . . 42.200000000000003 111.512 -179.721 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 53.9 m -94.98 134.67 37.4 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.382 -0.372 . . . . 64.239999999999995 111.039 -179.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 65' ' ' ALA . 12.7 p -122.96 135.8 61.85 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 CA-C-O 121.27 0.557 . . . . 74.319999999999993 112.202 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 42.6 p -128.84 141.34 51.32 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-N 116.053 -0.521 . . . . 73.439999999999998 110.008 173.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 52.0 p90 -139.72 160.87 38.9 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 112.608 0.596 . . . . 62.420000000000002 112.608 -174.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 91.1 m -149.93 109.67 4.06 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-N 115.785 -0.643 . . . . 75.349999999999994 110.154 178.701 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 48.6 mt -106.09 127.95 60.84 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 112.148 0.425 . . . . 74.150000000000006 112.148 -174.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 1' ' ' MET . 45.9 mtt180 -107.96 116.47 32.02 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 116.284 -0.416 . . . . 72.430000000000007 111.125 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 6.6 tt -117.78 125.23 50.23 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 120.882 0.373 . . . . 75.219999999999999 110.433 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.438 ' HB3' ' NE2' ' A' ' 82' ' ' HIS . 9.8 mp0 -71.84 96.13 1.62 Allowed 'General case' 0 CA--C 1.544 0.735 0 CA-C-O 120.918 0.389 . . . . 62.140000000000001 111.191 -178.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 8.6 p-80 -81.01 166.14 21.07 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 112.561 0.578 . . . . 75.349999999999994 112.561 -175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 40.9 m170 68.81 9.63 7.47 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.547 0.739 . . . . 72.219999999999999 112.894 -177.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' HIS . . . . . 0.438 ' NE2' ' HB3' ' A' ' 79' ' ' GLU . 6.0 m170 -73.47 99.17 2.93 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 112.36 0.504 . . . . 61.039999999999999 112.36 -179.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -170.15 141.17 2.06 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.649 -0.705 . . . . 70.409999999999997 110.252 177.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -69.41 92.61 0.61 Allowed 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.352 0.596 . . . . 75.349999999999994 110.922 -179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' HIS . . . . . . . . . . . . . 20.3 p80 . . . . . 0 C--O 1.253 1.261 0 CA-C-N 115.474 -0.785 . . . . 71.329999999999998 112.559 -175.536 . . . . . . . . 0 0 . 1 stop_ save_